eF-site ID 3nf6-A PDB Code 3nf6 Chain A click to enlarge Title Structural basis for a new mechanism of inhibition of HIV integrase identified by fragment screening and structure based design Classification HYDROLASE/HYDROLASE INHIBITOR Compound Integrase Source (Q76353_9HIV1) Sequence A:  SPGIWQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQE TAYFLLKLAGRWPVKTVHTDNGSNFTSTTVKAACWWAGIK QEDGIPYNPQSQGVIESMNKELKKIIGQVRDQAEHLKTAV QMAVFIHNHKRKGYSAGERIVDIIATDIQ Description Functional site 1) chain A residue 66 type sequence T description BINDING SITE FOR RESIDUE SO4 A 2 source : AC1 2) chain A residue 67 type sequence H description BINDING SITE FOR RESIDUE SO4 A 2 source : AC1 3) chain A residue 111 type sequence K description BINDING SITE FOR RESIDUE SO4 A 2 source : AC1 4) chain A residue 136 type sequence K description BINDING SITE FOR RESIDUE SO4 A 2 source : AC1 5) chain A residue 159 type sequence K description BINDING SITE FOR RESIDUE SO4 A 2 source : AC1 6) chain A residue 71 type sequence K description BINDING SITE FOR RESIDUE SO4 A 4 source : AC2 7) chain A residue 166 type sequence R description BINDING SITE FOR RESIDUE SO4 A 4 source : AC2 8) chain A residue 171 type sequence H description BINDING SITE FOR RESIDUE SO4 A 4 source : AC2 9) chain A residue 172 type sequence L description BINDING SITE FOR RESIDUE SO4 A 4 source : AC2 10) chain A residue 184 type sequence N description BINDING SITE FOR RESIDUE EDO A 213 source : AC3 11) chain A residue 185 type sequence H description BINDING SITE FOR RESIDUE EDO A 213 source : AC3 12) chain A residue 123 type sequence S description BINDING SITE FOR RESIDUE CL A 1 source : AC4 13) chain A residue 125 type sequence T description BINDING SITE FOR RESIDUE CL A 1 source : AC4 14) chain A residue 85 type sequence E description BINDING SITE FOR RESIDUE ACY A 214 source : AC5 15) chain A residue 87 type sequence E description BINDING SITE FOR RESIDUE ACY A 214 source : AC5 16) chain A residue 100 type sequence F description BINDING SITE FOR RESIDUE ACY A 214 source : AC5 17) chain A residue 103 type sequence K description BINDING SITE FOR RESIDUE ACY A 214 source : AC5 18) chain A residue 104 type sequence L description BINDING SITE FOR RESIDUE ACY A 214 source : AC5 19) chain A residue 107 type sequence R description BINDING SITE FOR RESIDUE ACY A 214 source : AC5 20) chain A residue 169 type sequence A description BINDING SITE FOR RESIDUE IMV A 215 source : AC6 21) chain A residue 170 type sequence E description BINDING SITE FOR RESIDUE IMV A 215 source : AC6 22) chain A residue 171 type sequence H description BINDING SITE FOR RESIDUE IMV A 215 source : AC6 23) chain A residue 174 type sequence T description BINDING SITE FOR RESIDUE IMV A 215 source : AC6 24) chain A residue 79 type sequence V description BINDING SITE FOR RESIDUE IMV A 230 source : AC7 25) chain A residue 82 type sequence G description BINDING SITE FOR RESIDUE IMV A 230 source : AC7 26) chain A residue 84 type sequence I description BINDING SITE FOR RESIDUE IMV A 230 source : AC7 27) chain A residue 150 type sequence V description BINDING SITE FOR RESIDUE IMV A 230 source : AC7 28) chain A residue 154 type sequence M description BINDING SITE FOR RESIDUE IMV A 230 source : AC7 29) chain A residue 157 type sequence E description BINDING SITE FOR RESIDUE IMV A 230 source : AC7 30) chain A residue 183 type sequence H description BINDING SITE FOR RESIDUE IMV A 230 source : AC7 31) chain A residue 106 type sequence G description BINDING SITE FOR RESIDUE EDO B 213 source : BC1 32) chain A residue 107 type sequence R description BINDING SITE FOR RESIDUE EDO B 213 source : BC1 33) chain A residue 187 type sequence R description BINDING SITE FOR RESIDUE EDO B 214 source : BC2 34) chain A residue 107 type sequence R description BINDING SITE FOR RESIDUE EDO B 4 source : BC3 35) chain A residue 109 type sequence P description BINDING SITE FOR RESIDUE EDO B 4 source : BC3 36) chain A residue 107 type sequence R description BINDING SITE FOR RESIDUE ACY B 215 source : BC5 37) chain A residue 95 type sequence Q description BINDING SITE FOR RESIDUE IMV B 216 source : BC6 38) chain A residue 99 type sequence Y description BINDING SITE FOR RESIDUE IMV B 216 source : BC6 39) chain A residue 102 type sequence L description BINDING SITE FOR RESIDUE IMV B 216 source : BC6 40) chain A residue 125 type sequence T description BINDING SITE FOR RESIDUE IMV B 216 source : BC6 41) chain A residue 128 type sequence A description BINDING SITE FOR RESIDUE IMV B 216 source : BC6 42) chain A residue 129 type sequence A description BINDING SITE FOR RESIDUE IMV B 216 source : BC6 43) chain A residue 132 type sequence W description BINDING SITE FOR RESIDUE IMV B 216 source : BC6 44) chain A residue 64 type BINDING sequence D description source Swiss-Prot : SWS_FT_FI1 45) chain A residue 116 type BINDING sequence D description source Swiss-Prot : SWS_FT_FI1 46) chain A residue 152 type BINDING sequence E description BINDING => ECO:0000250|UniProtKB:P04585 source Swiss-Prot : SWS_FT_FI2

Display surface Download Links