Structure of PDB 8hcj Chain C Binding Site BS01

Receptor Information
>8hcj Chain C (length=432) Species: 762903 (Pseudopedobacter saltans DSM 12145) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
QNPIIQTMYTADPAPMVYNNRLYVYTTHDEDQSTWFNMNDWKVYSTNDMV
NWTDHGTILKYSDFAWAKGDAWAAQCVEKNGKFYLYVPVVSKVNNKGAIG
VAVGDSPLGPFYDVLGKPLVQSEWGDIDPTVFIDDDGQAHMYWGNPKLKY
VKLNEDMISYSGDIIEVPMTEESFGKRDGNPERPTKYEEGPWLYKRKDLY
YLFWPGGPLPEFIGYSTSKSAKGPWKYGGIVMPAEGKSFTNHPGVIDFRG
KTYFFYHNGALPGGSGFTRSVCVQELNFNKDGTIPQMKMTEGITKGIAAL
NPYQLTQAETISWSEHVKAFQNDKVGVFVRALQNGAYTSVKNVDFGDIGA
SAFSARVGTTHNGGVTMEIRMGSQEGPIAGTVKVPLTGGDDRWEIINVKL
DRKITGIQDVYFVFKGKASSNIMYFDYWKFSK
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 chain8hcj Chain C Residue 502 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8hcj Structure of GH43 family enzyme, Xylan 1, 4 Beta- xylosidase from pseudopedobacter saltans
Resolution2.566 Å
Binding residue
(original residue number in PDB)		Q328 E330 V348 D447
Binding residue
(residue number reindexed from 1)		Q307 E309 V327 D426
Annotation score4
Enzymatic activity
Enzyme Commision number 3.2.1.37: xylan 1,4-beta-xylosidase.
Gene Ontology
Molecular Function
GO:0004553 hydrolase activity, hydrolyzing O-glycosyl compounds
GO:0009044 xylan 1,4-beta-xylosidase activity
GO:0016798 hydrolase activity, acting on glycosyl bonds
GO:0030246 carbohydrate binding
GO:0046872 metal ion binding
Biological Process
GO:0005975 carbohydrate metabolic process
GO:0045493 xylan catabolic process

View graph for
Molecular Function
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Biological Process
External links
PDB RCSB:8hcj, PDBe:8hcj, PDBj:8hcj
PDBsum8hcj
PubMed
UniProtF0S5E9

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