Structure of PDB 6i7f Chain B Binding Site BS02

Receptor Information
>6i7f Chain B (length=137) Species: 129555 (Amphitrite ornata) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GFKQDIATLRGDLRTYAQDIFLAFLNKYPDEKRNFKNYVGKSDQELKSMA
KFGDHTEKVFNLMMEVADRATDCVPLASDASTLVQMKQHSGLTTGNFEKL
FVALVEYMRASGQSFDSQSWDRFGKNLVSALSSAGMK
Ligand information
Ligand ID5JC
InChIInChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H
InChIKeyHFZWRUODUSTPEG-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385Oc1ccc(Cl)cc1Cl
ACDLabs 12.01Clc1c(ccc(c1)Cl)O
OpenEye OEToolkits 1.7.6c1cc(c(cc1Cl)Cl)O
FormulaC6 H4 Cl2 O
Name2,4-dichlorophenol
ChEMBLCHEMBL1143
DrugBank
ZINCZINC000000388057
PDB chain6i7f Chain B Residue 202 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB6i7f High-throughput structures of protein-ligand complexes at room temperature using serial femtosecond crystallography.
Resolution1.85 Å
Binding residue
(original residue number in PDB)		F21 F35 H55 V59
Binding residue
(residue number reindexed from 1)		F21 F35 H55 V59
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

View graph for
Molecular Function
View graph for
Biological Process
External links
PDB RCSB:6i7f, PDBe:6i7f, PDBj:6i7f
PDBsum6i7f
PubMed31709063
UniProtQ9NAV7

[Back to BioLiP]