Structure of PDB 4ilz Chain A Binding Site BS04

Receptor Information
>4ilz Chain A (length=137) Species: 129555 (Amphitrite ornata) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GFKQDIATIRGDLRTYAQDIFLAFLNKYPDERRYFKNYVGKSDQELKSMA
KFGDHTEKVFNLMMEVADRATDCVPLASDANTLVQMKQHSSLTTGNFEKL
FVALVEYMRASGQSFDSQSWDRFGKNLVSALSSAGMK
Ligand information
Ligand IDIPA
InChIInChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3
InChIKeyKFZMGEQAYNKOFK-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 11.02OC(C)C
CACTVS 3.352
OpenEye OEToolkits 1.7.0		CC(C)O
FormulaC3 H8 O
NameISOPROPYL ALCOHOL;
2-PROPANOL
ChEMBLCHEMBL582
DrugBankDB02325
ZINCZINC000000901159
PDB chain4ilz Chain A Residue 209 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4ilz Structural and Kinetic Study of an Internal Substrate Binding Site in Dehaloperoxidase-Hemoglobin A from Amphitrite ornata.
Resolution1.91 Å
Binding residue
(original residue number in PDB)		R32 K41 S42 D43 L46
Binding residue
(residue number reindexed from 1)		R32 K41 S42 D43 L46
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0004601 peroxidase activity
GO:0005344 oxygen carrier activity
GO:0019825 oxygen binding
GO:0020037 heme binding
GO:0046872 metal ion binding
Biological Process
GO:0015671 oxygen transport
GO:0098869 cellular oxidant detoxification

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Molecular Function
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Biological Process
External links
PDB RCSB:4ilz, PDBe:4ilz, PDBj:4ilz
PDBsum4ilz
PubMed23480178
UniProtQ9NAV8

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