Structure of PDB 6daw Chain B Binding Site BS01

Receptor Information
>6daw Chain B (length=341) Species: 68232 (Streptomyces lusitanus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VPRGSHMMIRYVDLDAAEGAALDELTRSVLRDHGASSSPSLLDDLSLVAH
RMPPRLIRELRRFRTAEEASCLVVRGLPVDDRRLGPTPLDWREPPREPES
EVHEVFLTLATAHLGDIFGWSTLQNGRLVHDVLPVPSHENDQSGHGTVEL
AWHTEDGFHPYRCDYLLLLGLRNHDAVPTGVAGVDQVVLSDEHREVLSQP
RFLIRPDTEHLRHARTLAADRGSPHAVQLMQDEPEPCAVLFGHPDRPYLR
IDPAFMSPLPGDPEAAAALEALTAELQRNLTDVVLSPGDLLVIDNYRVVH
GRAAFKARFDGTDRWLKKAVVTRDLRKSRAHRKSAAERVLL
Ligand information
Ligand IDFE2
InChIInChI=1S/Fe/q+2
InChIKeyCWYNVVGOOAEACU-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Fe+2]
CACTVS 3.341[Fe++]
FormulaFe
NameFE (II) ION
ChEMBL
DrugBankDB14510
ZINC
PDB chain6daw Chain B Residue 401 [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]
PDB6daw Two Distinct Mechanisms for C-C Desaturation by Iron(II)- and 2-(Oxo)glutarate-Dependent Oxygenases: Importance of alpha-Heteroatom Assistance.
Resolution2.1 Å
Binding residue
(original residue number in PDB)		H146 E148 H293
Binding residue
(residue number reindexed from 1)		H153 E155 H300
Annotation score4
Enzymatic activity
Enzyme Commision number 1.14.-.-
Gene Ontology
Molecular Function
GO:0005506 iron ion binding
GO:0016491 oxidoreductase activity
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:6daw, PDBe:6daw, PDBj:6daw
PDBsum6daw
PubMed29708749
UniProtS4TL40

[Back to BioLiP]