Structure of PDB 2w22 Chain A Binding Site BS02

Receptor Information

>2w22 Chain A (length=388) Species: 33938 (Geobacillus thermocatenulatus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]

ASPRANDAPIVLLHGFTGWGREEMLGFKYWGGVRGDIEQWLNDNGYRTYT
LAVGPLSSNWDRACEAYAQLVGGTVDYGAAHAAKHGHARFGRTYPGLLPE
LKRGGRVHIIAHSQGGQTARMLVSLLENGSQEEREYAKAHNVSLSPLFEG
GHHFVLSVTTIATPHDGTTLVNMVDFTDRFFDLQKAVLKAAAVASNVPYT
SQVYDFKLDQWGLRRQPGESFDHYFERLKRSPVWTSTDTARYDLSIPGAE
KLNQWVQASPNTYYLSFSTERTHRGALTGNYYPELGMNAFSAVVCAPFLG
SYRNEALGIDDRWLENDGIVNTVSMNGPKRGSSDRIVPYDGTLKKGVWND
MGTYNVDHLEVIGVDPNPSFDIRAFYLRLAEQLASLRP

Ligand information

Ligand ID

InChI

InChI=1S/Zn/q+2

InChIKey

PTFCDOFLOPIGGS-UHFFFAOYSA-N

SMILES

Software	SMILES
CACTVS 3.341	[Zn++]
ACDLabs 10.04 OpenEye OEToolkits 1.5.0	[Zn+2]

Formula

Name

ZINC ION

PDB chain

2w22 Chain A Residue 402 [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	2w22 Activation of bacterial thermoalkalophilic lipases is spurred by dramatic structural rearrangements.
Resolution	2.2 Å
Binding residue (original residue number in PDB)	D62 H82 H88 D239
Binding residue (residue number reindexed from 1)	D61 H81 H87 D238
Annotation score	1

Enzymatic activity

Enzyme Commision number

3.1.1.3: triacylglycerol lipase.

Gene Ontology

	Molecular Function
GO:0004806	triacylglycerol lipase activity
GO:0016787	hydrolase activity
GO:0046872	metal ion binding

	Biological Process
GO:0016042	lipid catabolic process

	Cellular Component
GO:0005576	extracellular region

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Molecular Function

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Cellular Component

External links

PDB	RCSB:2w22, PDBe:2w22, PDBj:2w22
PDBsum	2w22
PubMed	19056729
UniProt	Q59260

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