Structure of PDB 1h6l Chain A Binding Site BS09

Receptor Information
>1h6l Chain A (length=353) Species: 1390 (Bacillus amyloliquefaciens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KLSDPYHFTVNAAAETEPVDTAGDAADDPAIWLDPKNPQNSKLITTNKKS
GLAVYSLEGKMLHSYHTGKLNNVDIRYDFPLNGKKVDIAAASNRSEGKNT
IEIYAIDGKNGTLQSITDPNRPIASAIDEVYGFSLYHSQKTGKYYAMVTG
KEGEFEQYELNADKNGYISGKKVRAFKMNSQTEGMAADDEYGSLYIAEED
EAIWKFSAEPDGGSNGTVIDRADGRHLTPDIEGLTIYYAADGKGYLLASS
QGNSSYAIYERQGQNKYVADFQITDGPETDGTSDTDGIDVLGFGLGPEYP
FGLFVAQNGENIDHGQKANQNFKMVPWERIADKIGFHPQVNKQVDPRKMT
DRS
Ligand information
Ligand IDPO4
InChIInChI=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)/p-3
InChIKeyNBIIXXVUZAFLBC-UHFFFAOYSA-K
SMILES
SoftwareSMILES
CACTVS 3.341[O-][P]([O-])([O-])=O
ACDLabs 10.04[O-]P([O-])([O-])=O
OpenEye OEToolkits 1.5.0[O-]P(=O)([O-])[O-]
FormulaO4 P
NamePHOSPHATE ION
ChEMBL
DrugBankDB14523
ZINC
PDB chain1h6l Chain A Residue 502 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1h6l Enzyme Mechanism and Catalytic Property of Beta Propeller Phytase
Resolution1.8 Å
Binding residue
(original residue number in PDB)		K76 R122 Y159 K179
Binding residue
(residue number reindexed from 1)		K48 R94 Y131 K151
Annotation score1
Enzymatic activity
Enzyme Commision number 3.1.3.8: 3-phytase.
Gene Ontology
Molecular Function
GO:0016158 3-phytase activity
GO:0016787 hydrolase activity
Cellular Component
GO:0005576 extracellular region

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Molecular Function
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Cellular Component
External links
PDB RCSB:1h6l, PDBe:1h6l, PDBj:1h6l
PDBsum1h6l
PubMed11566134
UniProtO66037|PHYT_BACSD 3-phytase (Gene Name=phy)

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