Structure of PDB 6h91 Chain B Binding Site BS02

Receptor Information

>6h91 Chain B (length=218) Species: 272623 (Lactococcus lactis subsp. lactis Il1403)

MFKAVLFDLDGVITDTAEYHFRAWKALAEEIGINGVDRQFNEQLKGVSRE
DSLQKILDLADKKVSAEEFKELAKRKNDNYVKMIQDVSPADVYPGILQLL
KDLRSNKIKIALASASKNGPFLLERMNLTGYFDAIADPAEVAASKPAPDI
FIAAAHAVGVAPSESIGLEDSQAGIQAIKDSGALPIGVGRPEDLGDDIVI
VPDTSHYTLEFLKEVWLQ

Ligand information

• Ligand ID: UVW
• InChI: InChI=1S/C2H5O5P/c1-2(3)7-8(4,5)6/h1H3,(H2,4,5,6)
• InChIKey: LIPOUNRJVLNBCD-UHFFFAOYSA-N
• SMILES:
  CACTVS 3.341: CC(=O)O[P](O)(O)=O
  OpenEye OEToolkits 1.5.0: CC(=O)OP(=O)(O)O
  ACDLabs 10.04: O=C(OP(=O)(O)O)C
• Formula: C2 H5 O5 P
• Name: ACETYLPHOSPHATE
• DrugBank: DB02897
• ZINC: ZINC000003869379
• PDB chain: 6h91 Chain B Residue 303

Receptor-Ligand Complex Structure

Structure summary

• PDB: 6h91 Transition state of phospho-enzyme hydrolysis in beta-phosphoglucomutase
• Resolution: 2.38 Å
• Binding residue (original residue number in PDB): H20 R49 K117
• Binding residue (residue number reindexed from 1): H20 R49 K117
• Annotation score: 1

Enzymatic activity

• Enzyme Commision number: 5.4.2.6: beta-phosphoglucomutase.

Gene Ontology

Molecular Function

• GO:0000287 magnesium ion binding
• GO:0008801 beta-phosphoglucomutase activity
• GO:0016853 isomerase activity
• GO:0046872 metal ion binding

Biological Process

• GO:0005975 carbohydrate metabolic process

Cellular Component

• GO:0005737 cytoplasm

External links

• PDB: RCSB:6h91, PDBe:6h91, PDBj:6h91
• PDBsum: 6h91
• UniProt: P71447|PGMB_LACLA Beta-phosphoglucomutase (Gene Name=pgmB)