Structure of PDB 3ou7 Chain D Binding Site BS02

Receptor Information
>3ou7 Chain D (length=213) Species: 67320 (Streptomyces luridus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TSHGLIESQLSYYRARASEYDATFVPYMDSAAPAALERLRAGNIRGDVLE
LASGTGYWTRHLSGLADRVTALDGSAEMIAEAGRHGLDNVEFRQQDLFDW
TPDRQWDAVFFAHWLAHVPDDRFEAFWESVRSAVAPGGVVEFVDVTDHER
RLEQQDDSEPEVAVRRTLQDGRSFRIVKVFRSPAELTERLTALGWSCSVD
EVHPGFLYATCRP
Ligand information
Ligand ID2HE
InChIInChI=1S/C2H7O4P/c3-1-2-7(4,5)6/h3H,1-2H2,(H2,4,5,6)
InChIKeySEHJHHHUIGULEI-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341OCC[P](O)(O)=O
OpenEye OEToolkits 1.5.0C(CP(=O)(O)O)O
ACDLabs 10.04O=P(O)(O)CCO
FormulaC2 H7 O4 P
Name(2-hydroxyethyl)phosphonic acid
ChEMBLCHEMBL1229938
DrugBank
ZINCZINC000004097146
PDB chain3ou7 Chain D Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3ou7 Characterization and structure of DhpI, a phosphonate O-methyltransferase involved in dehydrophos biosynthesis.
Resolution2.3 Å
Binding residue
(original residue number in PDB)		Y15 R18 V27 P28 H119 R168 K180
Binding residue
(residue number reindexed from 1)		Y13 R16 V25 P26 H117 R166 K178
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0008168 methyltransferase activity
Biological Process
GO:0009058 biosynthetic process
GO:0032259 methylation

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Molecular Function
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Biological Process
External links
PDB RCSB:3ou7, PDBe:3ou7, PDBj:3ou7
PDBsum3ou7
PubMed20876132
UniProtD7PC21

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