Structure of PDB 6kxl Chain B Binding Site BS03

Receptor Information

>6kxl Chain B (length=367) Species: 553088 (Chitiniphilus shinanonensis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]

SYRVVAYYISWGAYGRSYFPSDIDYSKVTHINYAFANIKDGEVVVGDPGV
DDGGKNNFTALRKAKKAHPHLRNLISVGGWSWSSGFSDAAATPEARKRFA
DSAVAFIRKYGFDGVDIDWEYPVEGGAENMKHRPEDKQNYTLLTRSLREA
LDTAGKADGKYYELTTAVWGNDKFIANTEMDKVSRDFDFINVMSYDFNGT
WNKFSGHNAPFVNDPAYDKPGIGKTFNVVSAVEAYLKAGVPADKLVVGVP
LYGYSWKGCAAGERNGEYQDCNGKGRGTWEDGNLDFTDIEKNLLNKKGFK
RYWNDTAKAAYLYNAETGEFVTYEDPQALKIKLDYIKSKGLGGAMYWEIT
ADRKQTLVNLIADELLT

Ligand information

Ligand ID

MXE

InChI

InChI=1S/C3H8O2/c1-5-3-2-4/h4H,2-3H2,1H3

InChIKey

XNWFRZJHXBZDAG-UHFFFAOYSA-N

SMILES

Software	SMILES
CACTVS 3.341 OpenEye OEToolkits 1.5.0	COCCO
ACDLabs 10.04	OCCOC

Formula

C3 H8 O2

Name

2-METHOXYETHANOL

PDB chain

6kxl Chain A Residue 502 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]

Receptor-Ligand Complex Structure

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Structure summary

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PDB	6kxl Expression, purification, crystallization and X-ray diffraction analysis of ChiL, a chitinase from Chitiniphilus shinanonensis.
Resolution	1.35 Å
Binding residue (original residue number in PDB)	G85 D86 W121
Binding residue (residue number reindexed from 1)	G46 D47 W82
Annotation score	1

Enzymatic activity

Enzyme Commision number

Gene Ontology

	Molecular Function
GO:0004553	hydrolase activity, hydrolyzing O-glycosyl compounds
GO:0008061	chitin binding
GO:0016798	hydrolase activity, acting on glycosyl bonds

	Biological Process
GO:0005975	carbohydrate metabolic process

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Molecular Function

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Biological Process

External links

PDB	RCSB:6kxl, PDBe:6kxl, PDBj:6kxl
PDBsum	6kxl
PubMed
UniProt	F8WSX2

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