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Structure paper

TitleGroup deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain
Journal, issue, pagesTo Be Published
Publish dateApr 26, 2024 (structure data deposition date)
AuthorsAschenbrenner, J.C. / Fairhead, M. / Godoy, A.S. / Balcomb, B.H. / Capkin, E. / Chandran, A.V. / Dolci, I. / Golding, M. / Koekemoer, L. / Lithgo, R.M. ...Aschenbrenner, J.C. / Fairhead, M. / Godoy, A.S. / Balcomb, B.H. / Capkin, E. / Chandran, A.V. / Dolci, I. / Golding, M. / Koekemoer, L. / Lithgo, R.M. / Marples, P.G. / Ni, X. / Oliva, G. / Thompson, W. / Tomlinson, C.W.E. / Wild, C. / Winokan, M. / Xavier, M.-A.E. / Fearon, D. / von Delft, F.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution1.32 - 1.91 Å
Structure data

PDB-7h6j:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z100643660 (CHIKV_MacB-x0270)
Method: X-RAY DIFFRACTION / Resolution: 1.44 Å

PDB-7h6k:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1041785508 (CHIKV_MacB-x0281)
Method: X-RAY DIFFRACTION / Resolution: 1.33 Å

PDB-7h6l:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z104492884 (CHIKV_MacB-x0289)
Method: X-RAY DIFFRACTION / Resolution: 1.33 Å

PDB-7h6m:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1079168976 (CHIKV_MacB-x0294)
Method: X-RAY DIFFRACTION / Resolution: 1.39 Å

PDB-7h6n:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1079512010 (CHIKV_MacB-x0295)
Method: X-RAY DIFFRACTION / Resolution: 1.52 Å

PDB-7h6o:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1102357527 (CHIKV_MacB-x0300)
Method: X-RAY DIFFRACTION / Resolution: 1.42 Å

PDB-7h6p:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1129283193 (CHIKV_MacB-x0305)
Method: X-RAY DIFFRACTION / Resolution: 1.39 Å

PDB-7h6q:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1148165337 (CHIKV_MacB-x0312)
Method: X-RAY DIFFRACTION / Resolution: 1.35 Å

PDB-7h6r:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1154747269 (CHIKV_MacB-x0314)
Method: X-RAY DIFFRACTION / Resolution: 1.42 Å

PDB-7h6s:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1162778919 (CHIKV_MacB-x0316)
Method: X-RAY DIFFRACTION / Resolution: 1.35 Å

PDB-7h6t:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1165350851 (CHIKV_MacB-x0317)
Method: X-RAY DIFFRACTION / Resolution: 1.34 Å

PDB-7h6u:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1216833237 (CHIKV_MacB-x0353)
Method: X-RAY DIFFRACTION / Resolution: 1.48 Å

PDB-7h6v:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1262633486 (CHIKV_MacB-x0394)
Method: X-RAY DIFFRACTION / Resolution: 1.43 Å

PDB-7h6w:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1267773765 (CHIKV_MacB-x0398)
Method: X-RAY DIFFRACTION / Resolution: 1.38 Å

PDB-7h6x:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1267800292 (CHIKV_MacB-x0399)
Method: X-RAY DIFFRACTION / Resolution: 1.33 Å

PDB-7h6y:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1270393711 (CHIKV_MacB-x0404)
Method: X-RAY DIFFRACTION / Resolution: 1.41 Å

PDB-7h6z:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1272494722 (CHIKV_MacB-x0406)
Method: X-RAY DIFFRACTION / Resolution: 1.32 Å

PDB-7h70:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1400796579 (CHIKV_MacB-x0436)
Method: X-RAY DIFFRACTION / Resolution: 1.39 Å

PDB-7h71:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1416571195 (CHIKV_MacB-x0441)
Method: X-RAY DIFFRACTION / Resolution: 1.32 Å

PDB-7h72:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1562205518 (CHIKV_MacB-x0477)
Method: X-RAY DIFFRACTION / Resolution: 1.36 Å

PDB-7h73:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1730522163 (CHIKV_MacB-x0505)
Method: X-RAY DIFFRACTION / Resolution: 1.38 Å

PDB-7h74:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z184825330 (CHIKV_MacB-x0522)
Method: X-RAY DIFFRACTION / Resolution: 1.41 Å

PDB-7h75:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z19755216 (CHIKV_MacB-x0540)
Method: X-RAY DIFFRACTION / Resolution: 1.44 Å

PDB-7h76:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z198194396 (CHIKV_MacB-x0543)
Method: X-RAY DIFFRACTION / Resolution: 1.4 Å

PDB-7h77:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z198195770 (CHIKV_MacB-x0544)
Method: X-RAY DIFFRACTION / Resolution: 1.4 Å

PDB-7h78:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z2033637875 (CHIKV_MacB-x0553)
Method: X-RAY DIFFRACTION / Resolution: 1.45 Å

PDB-7h79:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z228586974 (CHIKV_MacB-x0585)
Method: X-RAY DIFFRACTION / Resolution: 1.39 Å

PDB-7h7a:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z26333434 (CHIKV_MacB-x0620)
Method: X-RAY DIFFRACTION / Resolution: 1.36 Å

PDB-7h7b:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z2692078340 (CHIKV_MacB-x0632)
Method: X-RAY DIFFRACTION / Resolution: 1.47 Å

PDB-7h7c:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z31504642 (CHIKV_MacB-x0692)
Method: X-RAY DIFFRACTION / Resolution: 1.39 Å

PDB-7h7d:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z422410426 (CHIKV_MacB-x0721)
Method: X-RAY DIFFRACTION / Resolution: 1.46 Å

PDB-7h7e:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z432057220 (CHIKV_MacB-x0732)
Method: X-RAY DIFFRACTION / Resolution: 1.4 Å

PDB-7h7f:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z4628744292 (CHIKV_MacB-x0756)
Method: X-RAY DIFFRACTION / Resolution: 1.47 Å

PDB-7h7g:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z50145861 (CHIKV_MacB-x0760)
Method: X-RAY DIFFRACTION / Resolution: 1.37 Å

PDB-7h7h:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z600458168 (CHIKV_MacB-x0822)
Method: X-RAY DIFFRACTION / Resolution: 1.5 Å

PDB-7h7i:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z606937774 (CHIKV_MacB-x0824)
Method: X-RAY DIFFRACTION / Resolution: 1.53 Å

PDB-7h7j:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z728939702 (CHIKV_MacB-x0839)
Method: X-RAY DIFFRACTION / Resolution: 1.42 Å

PDB-7h7k:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z768399682 (CHIKV_MacB-x0858)
Method: X-RAY DIFFRACTION / Resolution: 1.41 Å

PDB-7h7l:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z815437698 (CHIKV_MacB-x0864)
Method: X-RAY DIFFRACTION / Resolution: 1.35 Å

PDB-7h7m:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z905065822 (CHIKV_MacB-x0888)
Method: X-RAY DIFFRACTION / Resolution: 1.49 Å

PDB-7h7n:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z915492990 (CHIKV_MacB-x0892)
Method: X-RAY DIFFRACTION / Resolution: 1.42 Å

PDB-7h7o:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z952016136 (CHIKV_MacB-x0894)
Method: X-RAY DIFFRACTION / Resolution: 1.39 Å

PDB-7h7p:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z32968340 (CHIKV_MacB-x0926)
Method: X-RAY DIFFRACTION / Resolution: 1.43 Å

PDB-7h7q:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z329734230 (CHIKV_MacB-x0927)
Method: X-RAY DIFFRACTION / Resolution: 1.56 Å

PDB-7h7r:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z33546965 (CHIKV_MacB-x0934)
Method: X-RAY DIFFRACTION / Resolution: 1.38 Å

PDB-7h7s:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z335807570 (CHIKV_MacB-x0935)
Method: X-RAY DIFFRACTION / Resolution: 1.37 Å

PDB-7h7t:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z385370362 (CHIKV_MacB-x0969)
Method: X-RAY DIFFRACTION / Resolution: 1.34 Å

PDB-7h7u:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with POB0112 (CHIKV_MacB-x0997)
Method: X-RAY DIFFRACTION / Resolution: 1.4 Å

PDB-7h7v:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with NCL-00023823 (CHIKV_MacB-x1075)
Method: X-RAY DIFFRACTION / Resolution: 1.54 Å

PDB-7h7w:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with NCL-00023825 (CHIKV_MacB-x1076)
Method: X-RAY DIFFRACTION / Resolution: 1.44 Å

PDB-7h7x:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with NCL-00024672 (CHIKV_MacB-x1091)
Method: X-RAY DIFFRACTION / Resolution: 1.46 Å

PDB-7h7y:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1198386795 (CHIKV_MacB-x1103)
Method: X-RAY DIFFRACTION / Resolution: 1.37 Å

PDB-7h7z:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1741970824 (CHIKV_MacB-x1108)
Method: X-RAY DIFFRACTION / Resolution: 1.39 Å

PDB-7h80:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z57127349 (CHIKV_MacB-x1112)
Method: X-RAY DIFFRACTION / Resolution: 1.78 Å

PDB-7h81:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z940713508 (CHIKV_MacB-x1114)
Method: X-RAY DIFFRACTION / Resolution: 1.49 Å

PDB-7h82:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z275118248 (CHIKV_MacB-x1116)
Method: X-RAY DIFFRACTION / Resolution: 1.43 Å

PDB-7h83:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1741982125 (CHIKV_MacB-x1118)
Method: X-RAY DIFFRACTION / Resolution: 1.45 Å

PDB-7h84:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z56866006 (CHIKV_MacB-x1123)
Method: X-RAY DIFFRACTION / Resolution: 1.38 Å

PDB-7h85:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z56896153 (CHIKV_MacB-x1125)
Method: X-RAY DIFFRACTION / Resolution: 1.35 Å

PDB-7h86:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z56968535 (CHIKV_MacB-x1131)
Method: X-RAY DIFFRACTION / Resolution: 1.53 Å

PDB-7h87:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1741968196 (CHIKV_MacB-x1132)
Method: X-RAY DIFFRACTION / Resolution: 1.53 Å

PDB-7h88:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1741972444 (CHIKV_MacB-x1134)
Method: X-RAY DIFFRACTION / Resolution: 1.68 Å

PDB-7h89:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z3219959731 (CHIKV_MacB-x1135)
Method: X-RAY DIFFRACTION / Resolution: 1.41 Å

PDB-7h8a:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z3225843273 (CHIKV_MacB-x1139)
Method: X-RAY DIFFRACTION / Resolution: 1.38 Å

PDB-7h8b:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z241119328 (CHIKV_MacB-x1145)
Method: X-RAY DIFFRACTION / Resolution: 1.39 Å

PDB-7h8c:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1741976468 (CHIKV_MacB-x1151)
Method: X-RAY DIFFRACTION / Resolution: 1.52 Å

PDB-7h8d:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z281773378 (CHIKV_MacB-x1175)
Method: X-RAY DIFFRACTION / Resolution: 1.61 Å

PDB-7h8e:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z303754556 (CHIKV_MacB-x1182)
Method: X-RAY DIFFRACTION / Resolution: 1.52 Å

PDB-7h8f:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z57299966 (CHIKV_MacB-x1183)
Method: X-RAY DIFFRACTION / Resolution: 1.42 Å

PDB-7h8g:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z228586860 (CHIKV_MacB-x1185)
Method: X-RAY DIFFRACTION / Resolution: 1.37 Å

PDB-7h8h:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z89269461 (CHIKV_MacB-x1188)
Method: X-RAY DIFFRACTION / Resolution: 1.44 Å

PDB-7h8i:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z362772344 (CHIKV_MacB-x1194)
Method: X-RAY DIFFRACTION / Resolution: 1.65 Å

PDB-7h8j:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z362020366 (CHIKV_MacB-x1198)
Method: X-RAY DIFFRACTION / Resolution: 1.58 Å

PDB-7h8k:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z56791928 (CHIKV_MacB-x1203)
Method: X-RAY DIFFRACTION / Resolution: 1.54 Å

PDB-7h8l:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z212053854 (CHIKV_MacB-x1213)
Method: X-RAY DIFFRACTION / Resolution: 1.54 Å

PDB-7h8m:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z33546644 (CHIKV_MacB-x1258)
Method: X-RAY DIFFRACTION / Resolution: 1.55 Å

PDB-7h8n:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z255114686 (CHIKV_MacB-x1260)
Method: X-RAY DIFFRACTION / Resolution: 1.46 Å

PDB-7h8o:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1203748449 (CHIKV_MacB-x1268)
Method: X-RAY DIFFRACTION / Resolution: 1.47 Å

PDB-7h8p:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z56912586 (CHIKV_MacB-x1271)
Method: X-RAY DIFFRACTION / Resolution: 1.5 Å

PDB-7h8q:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1079133092 (CHIKV_MacB-x1278)
Method: X-RAY DIFFRACTION / Resolution: 1.42 Å

PDB-7h8r:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z218760918 (CHIKV_MacB-x1288)
Method: X-RAY DIFFRACTION / Resolution: 1.53 Å

PDB-7h8s:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z104507896 (CHIKV_MacB-x1298)
Method: X-RAY DIFFRACTION / Resolution: 1.5 Å

PDB-7h8t:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z367659362 (CHIKV_MacB-x1299)
Method: X-RAY DIFFRACTION / Resolution: 1.43 Å

PDB-7h8u:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z104473678 (CHIKV_MacB-x1305)
Method: X-RAY DIFFRACTION / Resolution: 1.56 Å

PDB-7h8v:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z31725206 (CHIKV_MacB-x1315)
Method: X-RAY DIFFRACTION / Resolution: 1.38 Å

PDB-7h8w:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z19674820 (CHIKV_MacB-x1316)
Method: X-RAY DIFFRACTION / Resolution: 1.42 Å

PDB-7h8x:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z57169486 (CHIKV_MacB-x1320)
Method: X-RAY DIFFRACTION / Resolution: 1.5 Å

PDB-7h8y:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z57127903 (CHIKV_MacB-x1331)
Method: X-RAY DIFFRACTION / Resolution: 1.91 Å

PDB-7h8z:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z104511114 (CHIKV_MacB-x1335)
Method: X-RAY DIFFRACTION / Resolution: 1.47 Å

PDB-7h90:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1378432729 (CHIKV_MacB-x1337)
Method: X-RAY DIFFRACTION / Resolution: 1.45 Å

PDB-7h91:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z56347237 (CHIKV_MacB-x1338)
Method: X-RAY DIFFRACTION / Resolution: 1.48 Å

PDB-7h92:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z104472798 (CHIKV_MacB-x1353)
Method: X-RAY DIFFRACTION / Resolution: 1.43 Å

PDB-7h93:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z56889474 (CHIKV_MacB-x1365)
Method: X-RAY DIFFRACTION / Resolution: 1.44 Å

PDB-7h94:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z33546479 (CHIKV_MacB-x1371)
Method: X-RAY DIFFRACTION / Resolution: 1.49 Å

PDB-7h95:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z239125320 (CHIKV_MacB-x1372)
Method: X-RAY DIFFRACTION / Resolution: 1.49 Å

PDB-7h96:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z440625162 (CHIKV_MacB-x1379)
Method: X-RAY DIFFRACTION / Resolution: 1.5 Å

PDB-7h97:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z276614452 (CHIKV_MacB-x1397)
Method: X-RAY DIFFRACTION / Resolution: 1.54 Å

PDB-7h98:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z271099378 (CHIKV_MacB-x1402)
Method: X-RAY DIFFRACTION / Resolution: 1.54 Å

PDB-7h99:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z104475374 (CHIKV_MacB-x1406)
Method: X-RAY DIFFRACTION / Resolution: 1.43 Å

PDB-7h9a:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z56899125 (CHIKV_MacB-x1410)
Method: X-RAY DIFFRACTION / Resolution: 1.63 Å

PDB-7h9b:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1201619441 (CHIKV_MacB-x1417)
Method: X-RAY DIFFRACTION / Resolution: 1.61 Å

PDB-7h9c:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z31721188 (CHIKV_MacB-x1421)
Method: X-RAY DIFFRACTION / Resolution: 1.41 Å

PDB-7h9d:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z728187792 (CHIKV_MacB-x1423)
Method: X-RAY DIFFRACTION / Resolution: 1.53 Å

PDB-7h9e:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z234895085 (CHIKV_MacB-x1431)
Method: X-RAY DIFFRACTION / Resolution: 1.49 Å

PDB-7h9f:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z415653738 (CHIKV_MacB-x1435)
Method: X-RAY DIFFRACTION / Resolution: 1.61 Å

PDB-7h9g:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1203162487 (CHIKV_MacB-x1440)
Method: X-RAY DIFFRACTION / Resolution: 1.53 Å

PDB-7h9h:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z55692894 (CHIKV_MacB-x1444)
Method: X-RAY DIFFRACTION / Resolution: 1.54 Å

PDB-7h9i:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z68590124 (CHIKV_MacB-x1445)
Method: X-RAY DIFFRACTION / Resolution: 1.49 Å

PDB-7h9j:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z57376600 (CHIKV_MacB-x1454)
Method: X-RAY DIFFRACTION / Resolution: 1.88 Å

Chemicals

ChemComp-DMS:
DIMETHYL SULFOXIDE / DMSO, precipitant*YM / Dimethyl sulfoxide

ChemComp-TRS:
2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL / pH buffer*YM / Tris

ChemComp-CL:
Unknown entry / Chloride

ChemComp-LFO:
N,1-dimethyl-1H-indole-3-carboxamide

ChemComp-HOH:
WATER / Water

ChemComp-K34:
5-(1,3-thiazol-2-yl)-1H-1,2,4-triazole

ChemComp-SFY:
4-amino-N-(pyridin-2-yl)benzenesulfonamide / medication, antibiotic*YM / Sulfapyridine

ChemComp-YXK:
[1-(2,2,2-trifluoroethyl)-1H-imidazol-2-yl]acetonitrile

ChemComp-UWS:
6-methyl-2-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridazin-3(2H)-one

ChemComp-YX6:
N-[(3R)-6-oxopiperidin-3-yl]-1,3-thiazole-4-carboxamide

PDB-1ap2:
SINGLE CHAIN FV OF C219

ChemComp-SZY:
N-(4-methylpyridin-3-yl)acetamide

ChemComp-YG5:
2-(1H-indazol-1-yl)-N,N-dimethylacetamide

PDB-1am7:
Lysozyme from bacteriophage lambda

PDB-1ap3:
Unknown entry

PDB-1ajz:
STRUCTURE OF DIHYDROPTEROATE PYROPHOSPHORYLASE

PDB-1aj2:
CRYSTAL STRUCTURE OF A BINARY COMPLEX OF E. COLI DIHYDROPTEROATE SYNTHASE

ChemComp-UQJ:
3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide

ChemComp-W0G:
(3R)-1-(2-fluorophenyl)-3-(methylamino)pyrrolidin-2-one

ChemComp-O2A:
N-methyl-1H-indole-7-carboxamide

ChemComp-Z5C:
5-(methoxymethyl)-1,2-oxazole-3-carboxamide

ChemComp-LF6:
{(1R,2R)-2-[(Z)-(3-methyl-1,2,4-thiadiazol-5(2H)-ylidene)amino]cyclopentyl}methanol

PDB-1ap4:
REGULATORY DOMAIN OF HUMAN CARDIAC TROPONIN C IN THE CALCIUM-SATURATED STATE, NMR, 40 STRUCTURES

ChemComp-WZ7:
2-[(cyclopent-3-en-1-yl)amino]pyridine-4-carboxamide

ChemComp-W17:
1-(2-hydroxyethyl)-1H-pyrazole-4-carboxamide

ChemComp-Q7X:
1-[(2R)-8-fluoro-2-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl]ethan-1-one

PDB-1ap5:
TYR34->PHE MUTANT OF HUMAN MITOCHONDRIAL MANGANESE SUPEROXIDE DISMUTASE

ChemComp-TT3:
2-(3-fluorophenoxy)-N,N-dimethylacetamide

ChemComp-K2M:
4-(furan-2-carbonyl)piperazine-1-carboxamide

ChemComp-LJA:
N-[3-(carbamoylamino)phenyl]acetamide

ChemComp-LRF:
N~2~-(4-cyano-3-methyl-1,2-thiazol-5-yl)-N~2~-methylglycinamide

PDB-1aj8:
CITRATE SYNTHASE FROM PYROCOCCUS FURIOSUS

ChemComp-RYM:
4-(benzimidazol-1-ylmethyl)benzenecarbonitrile

ChemComp-W1Y:
N-methyl-1-(1-phenyl-1H-pyrazol-4-yl)methanamine

ChemComp-WJD:
2-methoxy-N-phenylacetamide

PDB-1ap6:
TYR34->PHE MUTANT OF HUMAN MITOCHONDRIAL MANGANESE SUPEROXIDE DISMUTASE

ChemComp-UVG:
N,N-dimethyl-1H-pyrazole-4-carboxamide

PDB-1ap7:
P19-INK4D FROM MOUSE, NMR, 20 STRUCTURES

ChemComp-W1P:
5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one / medication*YM / Edaravone

PDB-1ap8:
TRANSLATION INITIATION FACTOR EIF4E IN COMPLEX WITH M7GDP, NMR, 20 STRUCTURES

ChemComp-U0V:
2-fluoro-N-[2-(pyridin-4-yl)ethyl]benzamide


ChemComp, No image

ChemComp-KCC:
Unknown entry

ChemComp-K0D:
[(2R,5S)-2,5-dimethylmorpholin-4-yl](1,2,5-thiadiazol-3-yl)methanone

ChemComp-Q7L:
(3P)-3-(2H-1,3-benzodioxol-5-yl)-1H-pyrazole

ChemComp-ZV5:
(5R)-1,3,7-triazaspiro[4.5]decane-2,4-dione

PDB-1ap9:
X-RAY STRUCTURE OF BACTERIORHODOPSIN FROM MICROCRYSTALS GROWN IN LIPIDIC CUBIC PHASES

ChemComp-JO1:
1-methyl-N-[(thiophen-2-yl)methyl]-1H-pyrazole-5-carboxamide


ChemComp, No image

ChemComp-KBU:
Unknown entry

PDB-1aqa:
SOLUTION STRUCTURE OF REDUCED MICROSOMAL RAT CYTOCHROME B5, NMR, MINIMIZED AVERAGE STRUCTURE

PDB-1aqb:
RETINOL-BINDING PROTEIN (RBP) FROM PIG PLASMA

ChemComp-ONQ:
~{N}-(2-azanyl-2-oxidanylidene-ethyl)-4-methoxy-benzamide

ChemComp-GT4:
~{N}-(4-hydroxyphenyl)-2-methoxy-ethanamide

PDB-1aqc:
X11 PTB DOMAIN-10MER PEPTIDE COMPLEX

PDB-1aqd:
HLA-DR1 (DRA, DRB1 0101) HUMAN CLASS II HISTOCOMPATIBILITY PROTEIN (EXTRACELLULAR DOMAIN) COMPLEXED WITH ENDOGENOUS PEPTIDE

PDB-1aqe:
CRYSTAL STRUCTURE OF THE Y73E MUTANT OF CYTOCHROME C OF CLASS III (AMBLER) 26 KD

ChemComp-HEW:
4-bromanylpyridin-2-amine

ChemComp-HGQ:
4-bromanyl-1~{H}-pyridin-2-one

ChemComp-UUS:
4-bromo-1-(2-hydroxyethyl)pyridin-2(1H)-one

ChemComp-HUH:
1~{H}-1,2,3-triazole / 1,2,3-Triazole

ChemComp-T5V:
pyrimidin-5-amine

ChemComp-SZB:
succinimide / Succinimide

ChemComp-BAQ:
pyrrolidin-2-one / 2-Pyrrolidone

ChemComp-HVK:
pyridin-2-amine / 2-Aminopyridine

ChemComp-T5Y:
pyridin-2-ol / 2-Pyridone

ChemComp-3TR:
3-AMINO-1,2,4-TRIAZOLE / inhibitor*YM / 3-Amino-1,2,4-triazole

ChemComp-XHD:
2-cyanoacetamide / Cyanoacetamide

ChemComp-XJJ:
piperazin-2-one

ChemComp-LGA:
PYRIMIDIN-2-AMINE

PDB-1asb:
THE STRUCTURAL BASIS FOR THE REDUCED ACTIVITY OF THE D223A(D222A) ACTIVE SITE MUTANT OF E. COLI ASPARTATE AMINOTRANSFERASE

ChemComp-W3G:
pyridazin-3(2H)-one

ChemComp-IRU:
1~{H}-pyrazol-5-ylmethanol

ChemComp-3AX:
1H-pyrazol-5-amine

ChemComp-XJV:
imidazolidin-2-one

ChemComp-T9F:
4-(4-methoxyphenyl)-1,2,3,6-tetrahydropyridine

PDB-1aqf:
PYRUVATE KINASE FROM RABBIT MUSCLE WITH MG, K, AND L-PHOSPHOLACTATE

ChemComp-T1U:
(1-methyl-1H-benzimidazol-2-yl)methanol

PDB-1aqg:
NMR STRUCTURE OF THE RHODOPSIN-BOUND C-TERMINAL PEPTIDE OF THE TRANSDUCIN ALPHA-SUBUNIT, 20 STRUCTURES

ChemComp-W3Y:
(5S)-1-(4-chlorophenyl)-5-methylimidazolidine-2,4-dione

PDB-1aqh:
ALPHA-AMYLASE FROM ALTEROMONAS HALOPLANCTIS

ChemComp-W3S:
[1,2,4]triazolo[4,3-a]pyridin-3-amine

ChemComp-ES7:
1-methyl-1H-benzimidazol-2-amine

PDB-1ajr:
REFINEMENT AND COMPARISON OF THE CRYSTAL STRUCTURES OF PIG CYTOSOLIC ASPARTATE AMINOTRANSFERASE AND ITS COMPLEX WITH 2-METHYLASPARTATE

ChemComp-PZA:
PYRAZINE-2-CARBOXAMIDE / medication*YM / Pyrazinamide

ChemComp-ES5:
quinolin-6-amine

ChemComp-EVH:
1H-imidazole-2-sulfonamide

ChemComp-ABV:
1,3-benzothiazol-2-amine

ChemComp-92P:
1H-PYRROLO[2,3-B]PYRIDINE-3-CARBOXYLIC ACID

ChemComp-HLR:
1,2-benzoxazol-3-amine

ChemComp-CFF:
CAFFEINE / medication*YM / Caffeine (data page)

PDB-1aqi:
STRUCTURE OF ADENINE-N6-DNA-METHYLTRANSFERASE TAQI

ChemComp-BZX:
1,3-benzodioxol-5-ol / antiinflammatory, antidepressant*YM / Sesamol

ChemComp-LAZ:
N-(2-AMINOETHYL)-P-CHLOROBENZAMIDE

ChemComp-MPB:
4-HYDROXY-BENZOIC ACID METHYL ESTER / Methylparaben

ChemComp-COU:
COUMARIN / Coumarin

ChemComp-ISN:
ISATIN / Isatin

ChemComp-4JM:
4-(methylsulfanyl)aniline

ChemComp-EVD:
1-benzofuran-2-sulfonamide

ChemComp-2AQ:
QUINOLIN-2-AMINE

ChemComp-AMT:
2-AMINOTHIAZOLE / 2-Aminothiazole

ChemComp-URA:
URACIL / Uracil

ChemComp-WCE:
3-CHLORO-BENZAMIDE

ChemComp-5MK:
2-azanyl-5-chloranyl-benzamide

ChemComp-DBJ:
2,3-dihydro-1,4-benzodioxin-5-ylmethanol

ChemComp-LZ1:
1H-indazole / Indazole

ChemComp-GVH:
1H-PYRROLO[2,3-B]PYRIDINE

ChemComp-LG4:
5-METHYLPYRIDIN-2-AMINE

ChemComp-FBB:
6-fluoro-1,3-benzothiazol-2-amine

ChemComp-DEE:
3,5-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER

PDB-1aqj:
STRUCTURE OF ADENINE-N6-DNA-METHYLTRANSFERASE TAQI

ChemComp-4FL:
4-(1H-imidazol-2-yl)pyridine

ChemComp-4FS:
quinolin-3-amine

ChemComp-W6D:
1H-indole-4-carboxamide

ChemComp-1SQ:
ISOQUINOLIN-1-AMINE

ChemComp-8P7:
2-methyl-1~{H}-benzimidazole

ChemComp-OHB:
salicylamide / Salicylamide

ChemComp-4JO:
5-bromo-6-methylpyridin-2-amine

Source
  • chikungunya virus
KeywordsVIRAL PROTEIN / Diamond Light Source / I04-1 / READDI / Chikungunya Virus / crystallographic fragment screening / PanDDA / XChemExplorer

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