PDBsum entry 7v8s

Flavoprotein

PDB id: 7v8s

Contents

Protein chains

529 a.a.

Ligands

FAD ×2

NAP ×2

Metals

_NA ×5

Waters ×533

PDB id:

7v8s

Name:

Flavoprotein

Title:

Crystal structure of cyclohexanone monooxygenase from t. Municipale mutant l437t complexed with NADP+ and fad in space group of p1211

Structure:

Cyclohexanone monooxygenase from thermocrispum municipale. Chain: a, b. Engineered: yes. Mutation: yes

Source:

Thermocrispum municipale. Organism_taxid: 37926. Expressed in: escherichia coli bl21(de3). Expression_system_taxid: 469008.

Resolution:

2.08Å R-factor: 0.174 R-free: 0.218

Authors:

T.Li,G.Y.Li,H.Yin

Key ref:

Y.J.Dong et al. (2022). Biocatalytic baeyer-Villiger reactions: uncovering th source of regioselectivity at each evolutionary stage mutant with scrutiny of fleeting chiral intermediates. Acs catalysis, 12, 3669.

Date:

23-Aug-21 Release date: 06-Jul-22

Protein chains

A0A1L1QK40  (A0A1L1QK40_9PSEU) -  Cyclohexanone Monooxygenase from Thermocrispum municipale from Thermocrispum municipale

Seq: 541 a.a.

Struc: 529 a.a.*

* PDB and UniProt seqs differ at 1 residue position (black cross)

Enzyme reactions

• Enzyme class: E.C.1.14.13.22 - cyclohexanone monooxygenase.
• Pathway: Cyclohexanone Monooxygenase
• Reaction: cyclohexanone + NADPH + O2 + H⁺ = hexano-6-lactone + NADP⁺ + H2O

cyclohexanone + NADPH + O2 (Bound ligand (Het Group name = NAP) corresponds exactly) + H(+) = hexano-6-lactone + NADP(+) + H2O

• Cofactor: FAD

FAD (Bound ligand (Het Group name = FAD) corresponds exactly)

Molecule diagrams generated from .mol files obtained from the KEGG ftp site