TargetGroupModelMean alignment errorTM backbone RMSD (# residues)TM QsuperECL2 backbone RMSD (# residues)Protein prediction Z-scorePocket residue RMSD/TM/ECL2Ligand fingerprint prediction accuracyLigand RMSDLigand-pocket contact strength(# residues)/model/targetContact prediction accuracyCorrectnessComments
5HT2BWarsaw30.2.12(191)61%5.54(19)0.462.69(23)/1.37(16)/5.55(4)76%1.05(1.07)44.44(14)/83.75(15)/95.98(23)50%(64%)5.11%
5HT2BMerzPharma30.232.68(191)55%9.79(19)-1.045.46(23)/3.19(16)/11.19(4)68%1.14(0.68)40.34(11)/82.81(17)/95.98(23)45%(68%)3.92%
5HT2BMerzPharma20.212.68(191)55%9.81(19)-1.045.49(23)/3.27(16)/11.15(4)68%1.37(0.66)40.1(13)/82.73(17)/95.98(23)45%(73%)3.37%
5HT2BMerzPharma10.232.69(191)54%9.85(19)-1.065.51(23)/3.28(16)/11.17(4)67%1.39(0.76)39.14(12)/83.16(17)/95.98(23)44%(73%)3.15%
5HT2BStockholm-Carlsson20.2.16(191)59%6.32(19)0.271.95(23)/1.68(16)/2.26(4)79%1.64(1.74)41.22(10)/88.43(19)/95.98(23)45%(44%)2.82%
5HT2BCopenhagen-Norn10.2.38(191)54%7.51(19)-0.243.8(23)/2.8(16)/6.52(4)63%1.58(1.72)28.52(8)/54.17(15)/95.98(23)41%(47%)2.5%
5HT2BStockholm-Carlsson40.2.26(191)61%4.39(19)0.51.88(23)/1.53(16)/2.29(4)77%2.46(1.11)40.3(11)/62.83(15)/95.98(23)53%(66%)2.37%
5HT2BPadova20.2.03(191)62%8.74(19)-0.014.36(23)/2.37(16)/7.84(4)69%2.45(1.38)36.15(9)/74.81(16)/95.98(23)43%(65%)1.64%
5HT2BUCBPharma-Sands40.2.75(191)63%4.55(19)-0.172.65(23)/1.93(16)/3.95(4)74%2.81(2.46)42.13(10)/96.98(18)/95.98(23)44%(49%)1.38%
5HT2BPompeuFabra40.2.07(191)61%8.83(19)-0.073.46(23)/1.57(16)/7.61(4)73%2.09(1.8)32.13(10)/93.62(19)/95.98(23)34%(47%)1.36%
5HT2BPompeuFabra50.2.07(191)61%6.74(19)0.33.65(23)/1.31(16)/8.24(4)75%2.29(2.49)30.1(10)/78.73(17)/95.98(23)35%(49%)1.27%
5HT2BLMC-Monash20.3.04(191)47%6.08(19)-0.823.83(23)/3.89(16)/1.99(4)67%2.73(1.87)35.19(8)/81.04(18)/95.98(23)40%(50%)1.25%
5HT2BUCBPharma-Pitt20.2.18(191)61%6.42(19)0.222.81(23)/1.56(16)/5.65(4)68%3.17(1.31)36.94(9)/99.7(17)/95.98(23)38%(53%)0.91%
5HT2BStockholm-Carlsson30.2.11(191)60%6.01(19)0.382.35(23)/1.65(16)/3.97(4)78%3.03(1.92)30.45(8)/83.16(21)/95.98(23)34%(39%)0.85%
5HT2BPompeuFabra10.2.06(191)61%8.49(19)-0.013.65(23)/1.48(16)/8.26(4)61%2.96(1.96)20.49(6)/55.76(12)/95.98(23)29%(41%)0.71%
5HT2BUMich-Zhang50.1.65(191)65%4.74(19)1.212.97(23)/2.03(16)/5.31(4)72%2.93(2.85)25.69(10)/84.82(17)/95.98(23)29%(34%)0.71%
5HT2BUCBPharma-Pitt10.2.26(191)54%7.36(19)-0.053.83(23)/2.41(16)/6.88(4)57%2.81(2.22)18.67(4)/55.73(14)/95.98(23)26%(35%)0.69%
5HT2BNCATS30.1.52(191)71%5.21(19)1.293.89(23)/1.71(16)/8.29(4)68%2.77(2.13)29.39(10)/154.72(20)/95.98(23)25%(33%)0.65%
5HT2BCopenhagen-Norn40.2.36(191)54%7.48(19)-0.23.82(23)/2.82(16)/6.6(4)73%3.27(1.65)24.79(8)/75.61(15)/95.98(23)29%(49%)0.62%
5HT2BPompeuFabra30.2.07(191)61%8.71(19)-0.063.65(23)/1.54(16)/8.15(4)68%3.46(2.67)24.87(8)/71.89(18)/95.98(23)30%(46%)0.59%
5HT2BCopenhagen-Norn20.2.11(191)62%9.17(19)-0.194.(23)/2.17(16)/7.88(4)69%3.68(1.03)25.41(7)/69.52(16)/95.98(23)32%(60%)0.56%
5HT2BStockholm-Carlsson10.2.2(191)61%5.19(19)0.422.16(23)/1.41(16)/3.41(4)69%3.63(1.96)29.02(8)/93.56(20)/95.98(23)31%(44%)0.56%
5HT2BCOH-Vaidehi20.2.07(191)63%6.97(19)0.263.13(23)/2.(16)/5.69(4)71%3.8(1.91)32.74(11)/108.(19)/95.98(23)32%(49%)0.54%
5HT2BEPFL20.2.47(191)59%8.06(19)-0.452.18(23)/1.61(16)/3.5(4)71%4.01(4.17)32.86(7)/92.77(14)/95.98(23)35%(32%)0.54%
5HT2BSchrödinger50.1.87(191)66%5.12(19)0.862.69(23)/1.91(16)/4.01(4)68%3.79(1.89)30.62(6)/101.33(19)/95.98(23)31%(44%)0.52%
5HT2BHelsinki-Xhaard50.2.09(191)62%6.96(19)0.252.82(23)/1.56(16)/5.66(4)71%3.6(1.62)29.42(10)/116.62(21)/95.98(23)28%(41%)0.51%
5HT2BSchrödinger30.1.88(191)66%5.21(19)0.832.56(23)/1.74(16)/4.3(4)71%4.24(0.73)35.8(11)/111.44(19)/95.98(23)35%(61%)0.49%
5HT2BPadova50.3.24(191)61%7.25(19)-1.283.75(23)/1.25(16)/8.51(4)58%2.94(2.92)20.17(5)/108.95(18)/95.98(23)20%(23%)0.48%
5HT2BUSC10.2.7(190)60%5.02(16)ND2.7(22)/2.29(16)/4.85(3)60%3.19(1.93)20.12(6)/86.18(18)/95.98(23)22%(38%)0.48%
5HT2BCOH-Vaidehi40.2.34(191)63%10.66(19)-0.765.48(23)/1.27(16)/13.02(4)57%3.38(1.38)25.13(7)/114.33(21)/95.98(23)24%(47%)0.48%
5HT2BUCBPharma-Sands20.2.21(191)60%5.88(19)0.291.99(23)/1.59(16)/2.83(4)66%4.05(2.36)30.95(8)/100.6(21)/95.98(23)32%(46%)0.47%
5HT2BKoreaU10.2.11(191)58%10.05(19)-0.355.46(23)/1.65(16)/12.69(4)60%3.38(1.7)26.59(7)/138.28(17)/95.98(23)23%(45%)0.47%
5HT2BWarsaw20.2.12(191)61%5.35(19)0.52.66(23)/1.36(16)/5.47(4)60%3.82(1.48)22.2(8)/71.59(15)/95.98(23)27%(50%)0.44%
5HT2BKoreaU20.2.09(191)60%9.92(19)-0.35.41(23)/1.6(16)/12.63(4)58%3.43(1.73)23.6(7)/120.82(17)/95.98(23)22%(46%)0.43%
5HT2BUCBPharma-Sands10.2.17(191)60%6.17(19)0.282.19(23)/1.67(16)/3.01(4)69%4.56(2.07)30.76(10)/92.09(23)/95.98(23)33%(51%)0.39%
5HT2BNCATS10.2.13(186)65%6.01(19)0.363.64(23)/1.61(16)/4.97(4)73%4.74(0.69)33.26(7)/100.97(21)/95.98(23)34%(67%)0.37%
5HT2BWarsaw10.2.12(191)61%5.18(19)0.532.48(23)/1.36(16)/4.94(4)71%4.(2.33)24.81(5)/105.51(19)/95.98(23)25%(40%)0.37%
5HT2BKoreaU30.2.09(191)61%9.9(19)-0.295.41(23)/1.42(16)/12.77(4)55%3.49(1.79)19.1(8)/115.25(16)/95.98(23)18%(35%)0.36%
5HT2BNCATS20.2.13(186)65%6.01(19)0.363.64(23)/1.61(16)/4.97(4)69%4.93(0.64)31.92(7)/100.88(19)/95.98(23)32%(63%)0.33%
5HT2BWarsaw40.2.24(191)61%5.52(19)0.312.91(23)/1.5(16)/5.71(4)58%3.77(2.52)15.87(4)/75.87(18)/95.98(23)19%(26%)0.32%
5HT2BPadova30.2.94(191)65%9.26(19)-1.274.62(23)/1.65(16)/8.85(4)67%4.59(1.85)24.26(7)/81.56(22)/95.98(23)28%(48%)0.32%
5HT2BBaylor-Barth10.1.82(186)67%3.97(19)1.132.1(23)/1.84(16)/2.81(4)71%4.72(0.97)24.96(8)/83.08(20)/95.98(23)28%(49%)0.31%
5HT2BEPFL10.2.47(191)59%8.08(19)-0.462.16(23)/1.62(16)/3.48(4)65%4.8(4.29)25.4(4)/93.9(22)/95.98(23)27%(24%)0.28%
5HT2BQUB10.2.07(186)57%5.4(19)0.553.38(23)/2.4(16)/5.4(4)60%4.33(3.23)14.6(5)/56.17(15)/95.98(23)21%(25%)0.27%
5HT2BUWash10.1.7(191)64%7.(19)0.733.35(23)/2.7(16)/5.32(4)60%4.85(1.44)25.45(7)/101.87(15)/95.98(23)26%(51%)0.27%
5HT2BCOH-Vaidehi10.2.01(191)65%7.3(19)0.283.18(23)/2.3(16)/5.72(4)74%5.13(1.28)29.09(7)/109.74(20)/95.98(23)28%(57%)0.26%
5HT2BKoreaU40.2.08(191)61%9.9(19)-0.295.41(23)/1.41(16)/12.77(4)59%4.12(1.92)17.51(6)/114.95(19)/95.98(23)17%(33%)0.26%
5HT2BCOH-Vaidehi30.1.95(191)59%8.66(19)0.113.37(23)/1.77(16)/7.01(4)62%5.11(1.24)26.86(7)/104.13(20)/95.98(23)27%(54%)0.25%
5HT2BLMC-Monash10.3.16(191)32%8.(19)-1.333.82(23)/3.57(16)/4.85(4)59%4.31(4.3)13.31(3)/61.49(14)/95.98(23)18%(37%)0.25%
5HT2BHelsinki-Xhaard20.1.73(191)67%5.2(19)1.033.54(23)/1.9(16)/7.26(4)59%5.19(3.86)27.37(8)/114.02(17)/95.98(23)26%(27%)0.24%
5HT2BPadova40.1.95(191)58%7.89(19)0.254.32(23)/2.22(16)/9.52(4)62%5.39(1.59)23.93(6)/74.92(20)/95.98(23)28%(52%)0.24%
5HT2BOxfordStats20.3.23(191)60%15.04(19)-2.75.58(23)/2.28(16)/12.74(4)63%5.(1.51)21.02(5)/81.39(14)/95.98(23)24%(42%)0.24%
5HT2BPompeuFabra20.2.07(191)61%7.42(19)0.183.37(23)/1.54(16)/7.1(4)60%5.13(2.89)22.05(9)/80.03(17)/95.98(23)25%(38%)0.23%
5HT2BNCATS50.2.13(186)65%6.01(19)0.363.64(23)/1.61(16)/4.97(4)61%5.24(1.65)25.85(6)/110.25(20)/95.98(23)25%(47%)0.22%
5HT2BCopenhagen-Gloriam20.2.21(191)60%7.1(19)0.063.29(23)/1.28(16)/7.25(4)61%5.03(2.44)17.86(5)/68.14(16)/95.98(23)22%(47%)0.22%
5HT2BPadova10.1.75(191)61%9.79(19)0.164.44(23)/2.27(16)/9.78(4)61%5.4(1.92)22.64(5)/77.29(21)/95.98(23)26%(48%)0.22%
5HT2BCopenhagen-Gloriam10.2.21(191)60%7.1(19)0.063.29(23)/1.28(16)/7.25(4)61%5.05(2.44)17.86(5)/70.61(16)/95.98(23)22%(47%)0.22%
5HT2BWarsaw50.2.12(191)61%5.54(19)0.462.69(23)/1.37(16)/5.55(4)67%4.45(3.4)14.(5)/84.71(18)/95.98(23)16%(29%)0.21%
5HT2BUNM50.2.23(191)61%6.16(19)0.212.3(23)/1.49(16)/4.24(4)62%5.54(1.29)24.61(7)/85.37(19)/95.98(23)27%(53%)0.21%
5HT2BSchrödinger20.1.9(191)62%5.17(19)0.812.31(23)/1.55(16)/3.53(4)57%5.4(1.88)24.99(7)/106.97(17)/95.98(23)25%(50%)0.21%
5HT2BCOH-Vaidehi50.2.35(191)62%10.57(19)-0.755.72(23)/1.97(16)/13.25(4)54%5.29(1.25)20.75(7)/89.15(22)/95.98(23)22%(42%)0.2%
5HT2BHoward30.433.04(191)59%7.85(19)-1.143.17(23)/2.86(16)/3.68(4)68%4.79(1.95)13.83(3)/79.5(18)/95.98(23)16%(28%)0.19%
5HT2BCopenhagen-Gloriam30.2.21(191)60%7.1(19)0.063.24(23)/1.27(16)/7.25(4)51%5.64(2.46)21.18(6)/80.25(18)/95.98(23)24%(47%)0.18%
5HT2BUCBPharma-Shi10.2.04(191)66%4.7(19)0.722.27(23)/1.78(16)/2.64(4)67%6.43(1.32)28.67(5)/81.03(15)/95.98(23)33%(59%)0.18%
5HT2BSchrödinger10.1.88(191)65%5.12(19)0.842.7(23)/1.7(16)/4.46(4)62%6.44(0.88)32.61(8)/109.7(21)/95.98(23)32%(64%)0.17%
5HT2BUNM20.1.72(189)68%7.44(19)0.623.4(23)/1.66(16)/4.92(4)49%5.14(3.32)15.67(4)/90.95(16)/95.98(23)17%(23%)0.17%
5HT2BCaltech-Poland-CSMC10.2.25(191)49%6.28(19)0.155.12(23)/3.88(16)/7.31(4)41%5.47(1.81)15.48(4)/64.25(15)/95.98(23)20%(50%)0.17%
5HT2BSchrödinger40.1.89(191)66%5.25(19)0.812.51(23)/1.61(16)/4.16(4)64%6.21(1.29)28.56(7)/105.1(20)/95.98(23)28%(59%)0.17%
5HT2BINRIA10.2.01(188)56%21.46(19)-2.35.77(23)/1.98(16)/12.68(4)41%4.65(4.68)9.04(4)/67.04(15)/95.98(23)11%(14%)0.17%
5HT2BUCBPharma-Sands50.2.23(191)62%4.68(19)0.482.76(23)/2.55(16)/2.27(4)55%6.47(1.78)21.35(6)/68.77(21)/95.98(23)27%(50%)0.14%
5HT2BGaTech10.1.68(191)65%5.69(19)1.2.61(23)/2.19(16)/3.58(4)72%5.24(3.9)11.96(4)/91.24(19)/95.98(23)13%(9%)0.14%
5HT2BCopenhagen-Gloriam40.2.23(191)60%7.02(19)0.053.35(23)/1.36(16)/7.34(4)55%5.69(3.17)13.29(4)/64.26(17)/95.98(23)17%(35%)0.14%
5HT2BUWash20.1.92(191)59%7.43(19)0.383.71(23)/2.98(16)/4.98(4)49%5.58(2.44)16.56(5)/120.7(24)/95.98(23)15%(28%)0.14%
5HT2BUppsala30.2.39(191)54%7.26(19)-0.23.11(23)/1.73(16)/6.24(4)55%5.83(2.12)17.81(4)/104.43(18)/95.98(23)18%(38%)0.13%
5HT2BNCATS40.2.04(191)61%10.48(19)-0.346.7(23)/2.11(16)/15.4(4)54%5.44(3.45)9.47(2)/57.12(15)/95.98(23)13%(22%)0.13%
5HT2BCaltech-Poland-CSMC20.2.33(191)47%7.97(19)-0.255.15(23)/3.59(16)/7.47(4)50%5.49(5.47)8.7(1)/53.68(13)/95.98(23)13%(19%)0.13%
5HT2BQUB20.2.07(186)57%5.4(19)0.553.38(23)/2.4(16)/5.4(4)60%5.74(2.21)11.03(6)/82.53(17)/95.98(23)12%(35%)0.11%
5HT2BQUB30.2.07(186)57%5.4(19)0.553.38(23)/2.4(16)/5.4(4)51%6.05(5.69)10.51(4)/54.3(11)/95.98(23)15%(14%)0.11%
5HT2BStockholm-Carlsson50.2.21(191)59%4.32(19)0.572.31(23)/1.38(16)/4.01(4)47%6.48(3.83)16.55(4)/76.59(16)/95.98(23)19%(31%)0.11%
5HT2BUCBPharma-Sands30.2.07(191)65%4.77(19)0.662.19(23)/1.74(16)/2.58(4)58%7.07(1.75)22.88(5)/91.47(17)/95.98(23)24%(48%)0.11%
5HT2BUppsala50.2.28(191)59%6.67(19)0.053.45(23)/1.68(16)/7.11(4)46%6.62(2.67)19.83(5)/145.39(20)/95.98(23)17%(33%)0.1%
5HT2BSNU10.1.94(191)65%6.97(19)0.432.56(23)/1.3(16)/5.16(4)59%5.75(4.44)8.57(3)/125.11(18)/95.98(23)8%(13%)0.1%
5HT2BHoward20.433.15(191)54%7.69(19)-1.253.43(23)/3.06(16)/3.73(4)59%5.83(3.66)8.47(3)/114.4(22)/95.98(23)8%(19%)0.09%
5HT2BEPFL50.2.48(191)59%8.08(19)-0.462.11(23)/1.57(16)/3.42(4)61%6.19(3.47)10.51(6)/86.84(22)/95.98(23)12%(23%)0.09%
5HT2BUppsala20.2.19(191)57%6.81(19)0.153.11(23)/1.56(16)/6.41(4)48%6.62(3.84)14.74(2)/92.56(16)/95.98(23)16%(28%)0.09%
5HT2BEPFL30.2.47(191)59%8.06(19)-0.452.15(23)/1.59(16)/3.49(4)65%6.2(3.71)9.81(5)/84.43(23)/95.98(23)11%(23%)0.09%
5HT2BSNU40.1.94(191)65%7.53(19)0.332.63(23)/1.26(16)/5.43(4)61%5.69(4.53)5.96(1)/120.83(18)/95.98(23)6%(13%)0.09%
5HT2BSNU20.1.94(191)65%6.33(19)0.553.36(23)/1.3(16)/7.46(4)59%5.75(4.44)5.66(1)/104.91(19)/95.98(23)6%(13%)0.09%
5HT2BUWash40.2.06(191)55%8.3(19)0.043.83(23)/3.44(16)/4.02(4)52%5.99(3.28)6.92(2)/81.53(20)/95.98(23)8%(16%)0.09%
5HT2BUWash30.1.72(191)64%7.64(19)0.592.79(23)/2.36(16)/3.01(4)57%5.81(4.47)3.94(1)/109.32(19)/95.98(23)4%(7%)0.08%
5HT2BUSciences10.2.61(191)60%11.84(19)-1.315.99(23)/1.87(16)/13.95(4)47%5.92(5.58)4.75(3)/132.05(22)/95.98(23)4%(8%)0.08%
5HT2BBaylor-Barth20.1.79(186)63%4.99(19)0.982.76(23)/1.95(16)/4.13(4)59%6.09(4.54)5.43(2)/138.71(19)/95.98(23)5%(6%)0.07%
5HT2BOxfordStats10.2.18(191)61%14.93(19)-1.335.87(23)/1.29(16)/14.02(4)45%6.62(3.69)7.79(1)/71.68(16)/95.98(23)9%(22%)0.07%
5HT2BMPI10.2.93(187)54%7.77(19)-0.983.8(23)/2.99(16)/6.14(4)50%6.18(4.77)3.9(1)/58.51(13)/95.98(23)5%(19%)0.07%
5HT2BEPFL40.2.47(191)59%8.06(19)-0.442.15(23)/1.62(16)/3.43(4)54%7.04(3.83)10.34(3)/79.67(15)/95.98(23)12%(28%)0.07%
5HT2BCDAC50.152.86(191)44%7.11(19)-0.785.11(23)/3.1(16)/10.43(4)41%5.98(4.96)1.11(0)/81.45(13)/95.98(23)1%(1%)0.07%
5HT2BHoward50.433.04(191)59%7.85(19)-1.143.16(23)/2.79(16)/4.13(4)51%6.81(4.13)8.04(2)/91.65(11)/95.98(23)9%(16%)0.07%
5HT2BUppsala40.2.28(191)57%6.(19)0.183.49(23)/2.24(16)/6.48(4)43%6.94(4.53)10.85(3)/138.3(20)/95.98(23)10%(19%)0.07%
5HT2BVanderbilt40.2.76(191)45%7.09(19)-0.644.45(23)/3.15(16)/8.6(4)46%6.76(6.82)4.43(1)/117.99(17)/95.98(23)4%(5%)0.06%
5HT2BUWash50.1.76(191)61%8.93(19)0.33.36(23)/2.49(16)/5.93(4)50%7.22(2.95)6.84(1)/98.74(22)/95.98(23)7%(14%)0.05%
5HT2BUMich-Zhang40.1.65(191)65%3.93(19)1.363.42(23)/2.84(16)/5.43(4)55%6.64(6.28)0.55(0)/59.59(18)/95.98(23)1%(0%)0.05%
5HT2BCDAC20.2.47(191)48%7.51(19)-0.345.33(23)/3.11(16)/10.9(4)34%6.76(6.38)0.98(0)/75.96(14)/95.98(23)1%(2%)0.05%
5HT2BCopenhagen-Norn30.2.4(191)53%7.55(19)-0.274.19(23)/3.14(16)/7.17(4)40%7.8(6.51)9.55(1)/101.(14)/95.98(23)10%(14%)0.05%
5HT2BVanderbilt50.2.89(191)47%9.4(19)-1.234.32(23)/2.84(16)/8.28(4)39%6.8(7.39)0.16(0)/107.14(17)/95.98(23)0%(0%)0.05%
5HT2BCaltech-Poland-CSMC30.1.71(191)65%6.03(19)0.94.31(23)/2.41(16)/7.49(4)52%7.97(9.52)8.38(2)/102.62(18)/95.98(23)8%(12%)0.04%
5HT2BINRIA30.2.01(188)56%21.46(19)-2.35.81(23)/2.11(16)/12.68(4)34%7.35(7.74)1.98(0)/71.42(17)/95.98(23)2%(2%)0.04%
5HT2BGaTech20.1.72(191)64%6.37(19)0.832.71(23)/2.3(16)/3.7(4)54%7.55(4.35)3.51(0)/114.62(22)/95.98(23)3%(7%)0.04%
5HT2BSNU30.1.94(191)65%6.7(19)0.482.37(23)/1.26(16)/4.67(4)43%7.52(6.3)2.26(1)/78.68(15)/95.98(23)3%(5%)0.04%
5HT2BCaltech-Poland-CSMC40.2.26(191)49%6.28(19)0.155.05(23)/3.79(16)/7.21(4)44%8.27(8.74)5.57(1)/55.33(14)/95.98(23)8%(14%)0.04%
5HT2BVanderbilt20.2.26(191)52%6.16(19)0.163.6(23)/2.7(16)/5.94(4)42%7.93(10.96)1.32(0)/99.56(18)/95.98(23)1%(0%)0.03%
5HT2BGaTech40.1.69(191)65%5.45(19)1.032.37(23)/2.15(16)/2.65(4)45%8.53(8.13)6.99(3)/109.99(18)/95.98(23)7%(7%)0.03%
5HT2BGaTech50.1.69(191)65%5.45(19)1.032.37(23)/2.15(16)/2.65(4)45%8.53(8.13)6.99(3)/109.99(18)/95.98(23)7%(7%)0.03%
5HT2BHoward40.432.97(191)57%7.89(19)-1.062.93(23)/2.81(16)/3.14(4)66%8.66(10.33)6.79(3)/89.69(19)/95.98(23)7%(10%)0.03%
5HT2BCopenhagen-Norn50.2.13(191)61%9.2(19)-0.224.09(23)/2.08(16)/8.21(4)59%9.22(9.29)10.23(2)/82.83(20)/95.98(23)12%(13%)0.03%
5HT2BUNice40.292.5(191)56%5.35(19)0.014.88(23)/4.41(16)/6.47(4)50%8.42(8.45)3.51(1)/109.31(19)/95.98(23)3%(7%)0.03%
5HT2BSNU50.1.94(191)65%7.45(19)0.353.05(23)/1.26(16)/6.61(4)57%8.29(9.72)1.51(1)/94.03(15)/95.98(23)2%(0%)0.03%
5HT2BBaylor-Barth50.1.77(186)64%6.08(19)0.822.55(23)/2.25(16)/2.54(4)54%8.79(10.15)3.08(1)/66.57(15)/95.98(23)4%(5%)0.03%
5HT2BVanderbilt30.2.49(191)48%6.64(19)-0.222.96(23)/2.55(16)/4.88(4)35%8.38(10.22)0.(0)/81.39(16)/95.98(23)0%(0%)0.03%
5HT2BBaylor-Barth40.1.98(186)57%4.18(19)0.892.17(23)/2.02(16)/3.11(4)50%9.09(10.49)6.15(2)/98.37(17)/95.98(23)6%(10%)0.03%
5HT2BUNice20.292.5(191)56%5.85(19)-0.095.19(23)/5.11(16)/5.35(4)60%8.82(9.12)2.97(1)/119.6(22)/95.98(23)3%(8%)0.03%
5HT2BUNM10.1.81(188)62%8.49(19)0.323.7(23)/1.98(16)/6.91(4)54%9.61(8.43)8.65(3)/81.91(14)/95.98(23)10%(13%)0.03%
5HT2BGaTech30.1.71(191)65%4.09(19)1.262.39(23)/2.31(16)/2.59(4)62%9.07(11.03)2.95(2)/91.66(17)/95.98(23)3%(0%)0.03%
5HT2BVanderbilt10.2.49(191)47%6.11(19)-0.123.69(23)/2.62(16)/6.84(4)51%8.79(9.83)0.48(0)/120.38(18)/95.98(23)0%(0%)0.03%
5HT2BCaltech-Poland-CSMC50.1.72(191)65%6.05(19)0.884.33(23)/2.51(16)/7.45(4)55%9.23(11.01)2.62(1)/102.53(18)/95.98(23)3%(3%)0.02%
5HT2BINRIA20.2.01(188)56%21.46(19)-2.35.81(23)/2.12(16)/12.68(4)38%9.42(12.66)3.35(1)/88.5(18)/95.98(23)4%(1%)0.02%
5HT2BUMich-Zhang20.1.88(191)62%10.47(19)-0.133.1(23)/2.52(16)/4.66(4)52%9.46(4.76)2.45(1)/104.67(20)/95.98(23)2%(7%)0.02%
5HT2BUNice10.292.52(191)55%5.94(19)-0.125.01(23)/5.03(16)/4.75(4)44%9.32(9.51)1.07(0)/139.54(23)/95.98(23)1%(2%)0.02%
5HT2BBaylor-Barth30.1.74(186)66%4.39(19)1.152.19(23)/2.13(16)/1.9(4)66%9.74(11.69)3.74(2)/80.84(18)/95.98(23)4%(3%)0.02%
5HT2BUNice50.292.5(191)56%5.86(19)-0.095.21(23)/5.05(16)/5.67(4)43%9.55(10.52)1.68(1)/140.72(24)/95.98(23)1%(1%)0.02%
5HT2BUMich-Zhang10.1.64(191)65%3.95(19)1.373.36(23)/2.73(16)/5.43(4)64%9.68(9.18)2.15(1)/77.9(16)/95.98(23)3%(4%)0.02%
5HT2BOxfordBiochem50.2.53(191)59%6.01(19)-0.143.73(23)/3.07(16)/5.98(4)55%10.34(6.43)6.31(1)/96.12(18)/95.98(23)7%(18%)0.02%
5HT2BOxfordBiochem20.2.19(191)66%5.65(19)0.363.97(23)/2.42(16)/7.59(4)44%10.74(7.06)11.07(2)/163.69(21)/95.98(23)9%(21%)0.02%
5HT2BUNice30.292.5(191)56%5.85(19)-0.095.22(23)/5.01(16)/5.83(4)45%10.18(10.34)3.52(1)/138.4(24)/95.98(23)3%(6%)0.02%
5HT2BOxfordBiochem40.2.52(191)62%5.64(19)-0.073.07(23)/2.22(16)/5.04(4)46%10.64(6.92)7.67(1)/115.98(19)/95.98(23)7%(16%)0.02%
5HT2BINRIA40.1.98(191)63%10.(19)-0.174.38(23)/1.22(16)/10.29(4)13%10.47(13.18)0.(0)/92.2(12)/95.98(23)0%(0%)0.02%
5HT2BOxfordBiochem30.2.61(191)56%6.21(19)-0.294.01(23)/3.61(16)/5.66(4)43%11.45(7.18)6.85(1)/86.28(17)/95.98(23)8%(19%)0.01%
5HT2BOxfordBiochem10.2.58(191)57%6.25(19)-0.263.6(23)/3.01(16)/5.12(4)40%12.01(7.58)6.81(1)/114.65(18)/95.98(23)7%(15%)0.01%
5HT2BMPI20.2.33(187)62%9.69(19)-0.563.63(23)/1.42(16)/8.16(4)28%11.97(15.03)0.49(0)/78.89(16)/95.98(23)1%(0%)0.01%
5HT2BINRIA50.1.98(191)63%10.(19)-0.174.38(23)/1.22(16)/10.29(4)16%13.89(12.57)0.(0)/85.29(12)/95.98(23)0%(0%)0.01%
5HT2BKoreaU50.2.09(191)59%9.99(19)-0.325.41(23)/1.6(16)/12.6(4)60%4.35(2.09)23.37(4)/153.16(20)/95.98(23)20%(38%)NDligand sterically impossible
5HT2BUNM30.2.23(191)61%6.16(19)0.212.3(23)/1.49(16)/4.24(4)65%8.91(8.26)7.54(2)/136.52(18)/95.98(23)7%(18%)NDligand sterically impossible
5HT2BUNM40.2.23(191)61%6.16(19)0.212.3(23)/1.49(16)/4.24(4)67%8.84(8.96)4.6(2)/114.53(16)/95.98(23)4%(12%)NDligand sterically impossible
5HT2BLSU10.2.09(191)51%8.61(19)-0.064.77(23)/3.21(16)/8.28(4)50%10.41(11.49)2.49(1)/114.57(15)/95.98(23)2%(4%)NDligand sterically impossible
5HT2BLSU20.1.95(191)53%8.59(19)0.124.76(23)/3.09(16)/8.76(4)48%9.6(9.38)1.99(1)/173.29(18)/95.98(23)2%(2%)NDligand sterically impossible
5HT2BLSU30.2.06(191)53%8.42(19)0.014.26(23)/3.16(16)/7.(4)42%8.9(9.5)7.51(3)/206.03(20)/95.98(23)6%(8%)NDligand sterically impossible
5HT2BLSU40.2.08(191)52%8.6(19)-0.054.74(23)/3.45(16)/8.17(4)55%10.19(11.41)3.14(1)/147.49(17)/95.98(23)3%(5%)NDligand sterically impossible
5HT2BLSU50.1.97(191)54%8.49(19)0.114.2(23)/3.07(16)/7.2(4)46%8.53(9.19)15.09(3)/251.15(19)/95.98(23)11%(10%)NDligand sterically impossible
5HT2BUppsala10.2.13(191)61%7.21(19)0.142.68(23)/1.41(16)/5.6(4)67%3.18(1.81)28.04(10)/135.44(21)/95.98(23)25%(35%)NDligand sterically impossible
5HT2BCopenhagen-Gloriam50.2.22(191)60%7.11(19)0.053.33(23)/1.4(16)/7.26(4)34%6.85(3.08)14.74(4)/138.85(22)/95.98(23)13%(38%)NDligand sterically impossible
5HT2BCDAC10.213.14(191)60%7.08(19)-1.124.13(23)/2.97(16)/7.43(4)47%5.25(3.94)8.18(3)/161.93(23)/95.98(23)7%(11%)NDligand sterically impossible
5HT2BCDAC30.213.14(191)60%7.08(19)-1.124.18(23)/2.97(16)/7.59(4)52%2.94(2.46)26.98(9)/222.34(19)/95.98(23)20%(42%)NDligand sterically impossible
5HT2BCDAC40.213.14(191)60%7.08(19)-1.124.18(23)/2.97(16)/7.59(4)54%5.1(3.24)13.42(5)/176.68(24)/95.98(23)11%(20%)NDligand sterically impossible
5HT2BHoward10.433.04(191)59%7.85(19)-1.143.16(23)/2.79(16)/4.13(4)62%5.18(1.48)17.32(6)/112.38(19)/95.98(23)17%(47%)NDligand sterically impossible
5HT2BHelsinki-Xhaard10.1.77(191)65%5.43(19)0.933.59(23)/1.93(16)/7.4(4)59%5.2(3.88)26.45(8)/120.88(16)/95.98(23)25%(27%)NDligand sterically impossible
5HT2BHelsinki-Xhaard30.1.72(191)67%5.46(19)0.983.6(23)/1.82(16)/7.1(4)65%5.03(2.84)27.81(7)/99.06(16)/95.98(23)29%(37%)NDligand sterically impossible
5HT2BHelsinki-Xhaard40.2.09(191)62%6.96(19)0.252.94(23)/1.54(16)/6.04(4)56%6.(1.38)17.74(4)/145.23(19)/95.98(23)15%(36%)NDligand sterically impossible
5HT2BNIID10.1.66(191)65%8.36(19)0.534.14(23)/1.57(16)/9.18(4)55%5.93(4.17)5.49(4)/212.89(20)/95.98(23)4%(7%)NDligand sterically impossible
5HT2BNIID20.1.66(191)65%8.36(19)0.534.14(23)/1.57(16)/9.18(4)56%5.61(3.96)4.97(2)/221.71(21)/95.98(23)4%(6%)NDligand sterically impossible
5HT2BNIID30.1.66(191)65%8.36(19)0.534.14(23)/1.57(16)/9.18(4)58%9.57(9.65)10.66(4)/237.61(20)/95.98(23)8%(7%)NDligand sterically impossible
5HT2BNIID40.1.65(186)69%9.12(19)0.413.57(23)/1.45(16)/8.11(4)49%8.11(8.13)6.63(2)/207.54(19)/95.98(23)5%(0%)NDligand sterically impossible
5HT2BNIID50.2.22(191)56%6.39(19)0.174.32(23)/2.37(16)/8.78(4)48%10.39(13.05)0.49(0)/179.92(18)/95.98(23)0%(1%)NDligand sterically impossible
5HT2BUMich-Zhang30.1.63(191)65%3.94(19)1.383.01(23)/1.92(16)/5.66(4)65%5.09(4.83)16.62(7)/140.75(17)/95.98(23)15%(19%)NDligand sterically impossible
5HT2BUSciences20.2.6(191)60%11.7(19)-1.295.78(23)/1.51(16)/13.67(4)30%6.58(3.51)14.21(3)/201.37(17)/95.98(23)11%(22%)NDligand sterically impossible
5HT2BUSciences30.2.39(191)58%9.86(19)-0.674.4(23)/1.87(16)/9.92(4)52%3.4(4.37)18.62(8)/215.68(21)/95.98(23)14%(18%)NDligand sterically impossible
5HT2BUSciences40.2.39(191)58%9.86(19)-0.674.4(23)/1.87(16)/9.92(4)55%3.24(3.89)19.46(7)/212.82(18)/95.98(23)15%(27%)NDligand sterically impossible
5HT2BUSciences50.2.35(191)60%11.85(19)-0.995.96(23)/1.45(16)/14.21(4)35%9.26(10.66)0.9(0)/220.81(15)/95.98(23)1%(1%)NDligand sterically impossible
5HT2BSoochow10.7.24(191)40%33.95(19)-11.2915.69(23)/8.05(16)/33.42(4)26%11.39(15.04)0.04(0)/90.79(12)/95.98(23)0%(0%)NDligand sterically impossible
5HT2BSoochow20.7.23(191)39%33.9(19)-11.2815.7(23)/8.11(16)/33.37(4)28%11.17(15.21)0.(0)/105.58(15)/95.98(23)0%(0%)NDligand sterically impossible
5HT2BSoochow30.7.23(191)39%33.92(19)-11.2815.74(23)/8.17(16)/33.41(4)25%11.18(15.76)0.11(0)/89.54(14)/95.98(23)0%(0%)NDligand sterically impossible
5HT2BSoochow40.7.22(191)40%33.91(19)-11.2715.69(23)/8.04(16)/33.38(4)26%11.28(15.6)0.24(0)/107.5(14)/95.98(23)0%(0%)NDligand sterically impossible
5HT2BSoochow50.7.23(191)40%33.96(19)-11.2915.69(23)/8.02(16)/33.43(4)27%10.78(15.28)0.81(0)/102.53(12)/95.98(23)1%(0%)NDligand sterically impossible