Structure of PDB 5u2o Chain A Binding Site BS01

Receptor Information
>5u2o Chain A (length=543) Species: 717605 (Thermobacillus composti KWC4) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MLPEFPKIAVVAGSEAESVFRVVDIGTGDVVYEGRLSDSVYDDASGDTVR
HADFGEWKRPGSYSVTVGRSSSAPFRIGNDVYRAPLIQAARSYTLARCGV
AIDDPVTGLRHDVCHAQDKQAMLFFEDPFHRQGDPIDVSGGWHDAGDYGK
YVPTGAVAAAQLMLAWEMRPELWRSLSLSLPAGLSEPERRAGLPDLLVEI
KYELDWLLRMQRPDGAVYLKVAGGAWPGYIRPEEDTADRYVFGLSTYGTA
QFAGAAAMGARVYAPFLPDYARKLLDAAIRAQRYLEQHPDPEFRYDEGQN
NGSGPYEKRTDREERFWAAAELLRTTDDARYDAYIREHFSDFLEGKTSAV
FWGNTVLLGQWAYVNAERADADHKASVRASLTAYADELVRWASANGYRSV
LRPTDYFWGSAREAMGRAQALLLADAVAPNRAYLETALDQAHWLFGRNAA
GTSFMTGIGMHSPQKPHHRLVASTQTLIPGLVVGGPNAQGGDPIMDRLLR
ESDPRVFPAKAYVDDWEAYSVNEPAIDYTAPAVFVLTRFAEDR
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain5u2o Chain A Residue 606 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5u2o Engineering glycoside hydrolase stability by the introduction of zinc binding.
Resolution1.46 Å
Binding residue
(original residue number in PDB)		C98 C114 H115 H143
Binding residue
(residue number reindexed from 1)		C98 C114 H115 H143
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0003824 catalytic activity
GO:0004553 hydrolase activity, hydrolyzing O-glycosyl compounds
GO:0008810 cellulase activity
GO:0016798 hydrolase activity, acting on glycosyl bonds
GO:0046872 metal ion binding
Biological Process
GO:0000272 polysaccharide catabolic process
GO:0005975 carbohydrate metabolic process

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Molecular Function
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Biological Process
External links
PDB RCSB:5u2o, PDBe:5u2o, PDBj:5u2o
PDBsum5u2o
PubMed29968680
UniProtA0A384E0U3

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