eF-site ID 2bt0-B PDB Code 2bt0 Chain B click to enlarge Title Novel, potent small molecule inhibitors of the molecular chaperone Hsp90 discovered through structure-based design Classification CHAPERONE Compound HEAT SHOCK PROTEIN HSP90-ALPHA Source Homo sapiens (Human) (HS90A_HUMAN) Sequence B:  EVETFAFQAEIAQLMSLIINTFYSNKEIFLRELISNSSDA LDKIRYESLTDPSKLDSGKELHINLIPNKQDRTLTIVDTG IGMTKADLINNLGTIAKSGTKAFMEALQAGADISMIGQFG VGFYSAYLVAEKVTVITKHNDDEQYAWESSAGGSFTVRTD TGEPMGRGTKVILHLKEDQTEYLEERRIKEIVKKHSQFIG YPITLFVEK Description Functional site 1) chain B residue 51 type sequence N description BINDING SITE FOR RESIDUE CT5 B1224 source : AC2 2) chain B residue 52 type sequence S description BINDING SITE FOR RESIDUE CT5 B1224 source : AC2 3) chain B residue 55 type sequence A description BINDING SITE FOR RESIDUE CT5 B1224 source : AC2 4) chain B residue 93 type sequence D description BINDING SITE FOR RESIDUE CT5 B1224 source : AC2 5) chain B residue 96 type sequence I description BINDING SITE FOR RESIDUE CT5 B1224 source : AC2 6) chain B residue 97 type sequence G description BINDING SITE FOR RESIDUE CT5 B1224 source : AC2 7) chain B residue 98 type sequence M description BINDING SITE FOR RESIDUE CT5 B1224 source : AC2 8) chain B residue 106 type sequence N description BINDING SITE FOR RESIDUE CT5 B1224 source : AC2 9) chain B residue 107 type sequence L description BINDING SITE FOR RESIDUE CT5 B1224 source : AC2 10) chain B residue 138 type sequence F description BINDING SITE FOR RESIDUE CT5 B1224 source : AC2 11) chain B residue 184 type sequence T description BINDING SITE FOR RESIDUE CT5 B1224 source : AC2 12) chain B residue 186 type sequence V description BINDING SITE FOR RESIDUE CT5 B1224 source : AC2 13) chain B residue 52 type BINDING sequence S description source Swiss-Prot : SWS_FT_FI1 14) chain B residue 94 type BINDING sequence T description source Swiss-Prot : SWS_FT_FI1 15) chain B residue 139 type BINDING sequence Y description source Swiss-Prot : SWS_FT_FI1 16) chain B residue 113 type BINDING sequence S description BINDING => ECO:0000250 source Swiss-Prot : SWS_FT_FI2 17) chain B residue 59 type MOD_RES sequence I description N6-acetyllysine => ECO:0000250|UniProtKB:P07901 source Swiss-Prot : SWS_FT_FI4 18) chain B residue 85 type MOD_RES sequence Q description N6-acetyllysine => ECO:0000250|UniProtKB:P07901 source Swiss-Prot : SWS_FT_FI4

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