Structure of PDB 4olt Chain B Binding Site BS06

Receptor Information
>4olt Chain B (length=237) Species: 878476 (Pseudomonas sp. LL2(2010)) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GTVDLDAPVQKDTAMSLVSSFENSSTDWQAQYGYLEDIADGRGYTGGLIG
FTSGTGDMLELVRAYSASSPGNPLEQYIPALEAVNGTDSHAGLGQGFEQA
WADAAETSEFRAAQDAERDRVYFDPAVAQGKADGLSALGQFAYYDTLVVH
GPGSQRDAFGGIRAEALSAALPPSQGGDETEYLEAFFDARNVIMREEPAH
ADTSRIDTAQRVFLQNGNFDLERPLTWSVYGDQYSLN
Ligand information
Ligand IDGCS
InChIInChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4-,5-,6-/m1/s1
InChIKeyMSWZFWKMSRAUBD-QZABAPFNSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O)N)O)O)O
CACTVS 3.341N[CH]1[CH](O)O[CH](CO)[CH](O)[CH]1O
OpenEye OEToolkits 1.5.0C(C1C(C(C(C(O1)O)N)O)O)O
CACTVS 3.341N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O
ACDLabs 10.04OC1C(O)C(OC(O)C1N)CO
FormulaC6 H13 N O5
Name2-amino-2-deoxy-beta-D-glucopyranose;
beta-D-glucosamine;
2-amino-2-deoxy-beta-D-glucose;
2-amino-2-deoxy-D-glucose;
2-amino-2-deoxy-glucose;
D-GLUCOSAMINE
ChEMBLCHEMBL234432
DrugBank
ZINCZINC000003860468
PDB chain4olt Chain D Residue 6 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4olt Structural insights into the substrate-binding mechanism for a novel chitosanase.
Resolution1.59 Å
Binding residue
(original residue number in PDB)
T58 H153 P155
Binding residue
(residue number reindexed from 1)
T55 H150 P152
Annotation score4
Enzymatic activity
Catalytic site (original residue number in PDB) E25 D43 T48
Catalytic site (residue number reindexed from 1) E22 D40 T45
Enzyme Commision number 3.2.1.132: chitosanase.
Gene Ontology
Molecular Function
GO:0016798 hydrolase activity, acting on glycosyl bonds
GO:0016977 chitosanase activity
Biological Process
GO:0005975 carbohydrate metabolic process
Cellular Component
GO:0005576 extracellular region

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Molecular Function

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Biological Process

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Cellular Component
External links
PDB RCSB:4olt, PDBe:4olt, PDBj:4olt
PDBsum4olt
PubMed24766439
UniProtE1AXU1

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