Brand  (β version)

PDB ID: 4LHT

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Ligands
Code Name Style Show Link
HEM Protoporphyrin ix containing Fe PoSSuM
CNL 1,3,3-trimethyl-2-oxabicyclo[2.2.2]octane PoSSuM
PEG Di(hydroxyethyl)ether PoSSuM
PGE Triethylene glycol PoSSuM
SO4 Sulfate ion PoSSuM
CL Chloride ion PoSSuM
Non-standard Residues
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Structure summary

Code : 4LHT   PDBj   RCSB PDB   PDBe
Header : OXIDOREDUCTASE
Title : Crystal Structure of P450cin Y81F mutant, crystallized in 3 mM 1,8-cineole
Release Data : 2013-07-24
Compound :
mol_id molecule chains
1 P450cin A,B
ec: 1.14.-.-
fragment: UNP residues 8-404
mutation: Y81F
Source :
mol_id organism_scientific expression_system
1 Citrobacter braakii  (taxid:57706) Escherichia coli  (taxid:668369)
gene: CIN A, cinA
expression_system_strain: NEB 5-alpha
expression_system_vector_type: plasmid
expression_system_plasmid: pcWori-P450cin
Authors : Madrona, Y., Poulos, T.L.
Keywords : P450 monooxygenase, cindoxin, OXIDOREDUCTASE
Exp. method : X-RAY DIFFRACTION ( 2.137 Å )
Citation :

P450cin active site water: implications for substrate binding and solvent accessibility.

Madrona, Y.,Hollingsworth, S.A.,Khan, B.  et al.
(2013)  Biochemistry  52 : 5039 - 5050

PubMed: 23829586
DOI: 10.1021/bi4006946

Reaction

Chain : A, B
UniProt : Q8VQF6 (CINA_CITBR)
Reaction: EC: Evidence:
Physiological Direction:
1,8-cineole + reduced [flavodoxin] + O2 = 2-endo-hydroxy-1,8- cineole + oxidized [flavodoxin] + H2O + H(+) 1.14.14.133 PubMed:12016226
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Cofactor: Evidence: Note:
heme ECO:0000269 | PubMed:15260491
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