Structure of PDB 7y9g Chain B Binding Site BS01

Receptor Information
>7y9g Chain B (length=311) Species: 54571 (Streptomyces venezuelae) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PGEFFLPPLPRLLPAGYHPDAARIEIASNGWVRRMLADCFDSEESLLFFL
RQRNGIYGPLTVPYAEADRAQNIADWYQFVTVIDSFVSDASLYGRAAQDL
WRRIAAGMSARQVDRLVAALEAFLRGCAEEIRSKLDKQVPHFEACMRVRV
DSFGCEFLELLTEYAAEVDMSRAATEGLFDEVHHHGMRQLILVNDLLSWR
KEYAQRDTMTTVRVLCEVEGLELQDAVDRLCALVEHHERAYITARDAVLA
GPHGHREDVRAYLSGLDHLIGGSQEFEYLTPRYFGDGSVWDGSTSGWISL
TASVARFRDAP
Ligand information
Ligand IDPOP
InChIInChI=1S/H4O7P2/c1-8(2,3)7-9(4,5)6/h(H2,1,2,3)(H2,4,5,6)/p-2
InChIKeyXPPKVPWEQAFLFU-UHFFFAOYSA-L
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0O[P@@](=O)([O-])O[P@@](=O)(O)[O-]
CACTVS 3.341O[P]([O-])(=O)O[P](O)([O-])=O
ACDLabs 10.04[O-]P(=O)(O)OP([O-])(=O)O
OpenEye OEToolkits 1.5.0OP(=O)([O-])OP(=O)(O)[O-]
FormulaH2 O7 P2
NamePYROPHOSPHATE 2-
ChEMBL
DrugBank
ZINC
PDB chain7y9g Chain B Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB7y9g Molecular insights into the catalytic promiscuity of a bacterial diterpene synthase.
Resolution2.18 Å
Binding residue
(original residue number in PDB)		D115 R211 N256 S260 K263 E264 R344 Y345
Binding residue
(residue number reindexed from 1)		D84 R149 N194 S198 K201 E202 R282 Y283
Annotation score4
External links