Structure of PDB 6grw Chain A Binding Site BS01

Receptor Information
>6grw Chain A (length=397) Species: 452637 (Opitutus terrae PB90-1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SAYTLPDPLVGADGTRVHDRATWQHRRRPELLQLFAREVYGRTPLGRPEG
MVFKVTTMEHAALGGAATRKEVTVRFGRDPNAPSMQLLLYVPNAVIARAE
RAPVFLGLNFYGNHTVHTDPAIALSARWIPAEAPNGANHRATEAARGSDA
QKWPVEQILARGYAVATVYCGDLCPDRPDGLNASVASWLAGDQRAPDAWG
AIGVWAWGLSRALDYLETDPLVDASRVAVHGHSRLGKAALWAGAQDDRFA
LVISNESGCGGAALSKRIHGETVARINTVFPHWFARNFRRYDDHEEALPV
DQHELLALVAPRPLYVASAEDDDWADPRGEFLAVKAAEPVFRLFGQTGPS
GEDVPRVNEPSGGALRYHIRPGPHGMTAQDWAFYLAFADEWLKSALP
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain6grw Chain A Residue 503 [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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PDB6grw Biochemical and structural features of diverse bacterial glucuronoyl esterases facilitating recalcitrant biomass conversion.
Resolution1.5 Å
Binding residue
(original residue number in PDB)		H303 E305
Binding residue
(residue number reindexed from 1)		H269 E271
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:6grw, PDBe:6grw, PDBj:6grw
PDBsum6grw
PubMed30083226
UniProtB1ZMF4

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