Structure of PDB 1gmm Chain A Binding Site BS01

Receptor Information
>1gmm Chain A (length=126) Species: 1515 (Acetivibrio thermocellus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
FSKIESEEYNSLKSSTIQTIGTSDGGSGIGYIESGDYLVFNKINFGNGAN
SFKARVASGADTPTNIQLRLGSPTGTLIGTLTVASTGGWNNYEEKSCSIT
NTTGQHDLYLVFSGPVNIDYFIFDSN
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 chain1gmm Chain A Residue 1132 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1gmm The Location of the Ligand-Binding Site of Carbohydrate-Binding Modules that Have Evolved from a Common Sequence is not Conserved.
Resolution2.0 Å
Binding residue
(original residue number in PDB)		E8 E10 S30 D122
Binding residue
(residue number reindexed from 1)		E5 E7 S27 D119
Annotation score4
Enzymatic activity
Enzyme Commision number 3.2.1.8: endo-1,4-beta-xylanase.
Gene Ontology
Molecular Function
GO:0030246 carbohydrate binding

View graph for
Molecular Function
External links
PDB RCSB:1gmm, PDBe:1gmm, PDBj:1gmm
PDBsum1gmm
PubMed11673472
UniProtO52780

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