PDBsum entry 4ync

Oxidoreductase

PDB id: 4ync

Contents

Protein chain

397 a.a.

Ligands

FMN

4EG

Metals

_CL

Waters ×545

PDB id:

4ync

Name:

Oxidoreductase

Title:

Oye1 w116a complexed with (z)-methyl-3-cyano-3-phenylacrylate in a non productive binding mode

Structure:

NADPH dehydrogenase 1. Chain: a. Synonym: old yellow enzyme 1. Engineered: yes. Mutation: yes

Source:

Saccharomyces pastorianus. Lager yeast. Organism_taxid: 27292. Gene: oye1. Expressed in: escherichia coli bl21(de3). Expression_system_taxid: 469008.

Resolution:

1.50Å R-factor: 0.156 R-free: 0.173

Authors:

S.Santangelo,E.Brenna,J.D.Stewart,R.W.Powell Iii

Key ref:

E.Brenna et al. (2015). Opposite enantioselectivity in the bioreduction of (z)-Beta-Aryl-Beta-Cyanoacrylates mediated by the try 116 mutants of old yellow enzyme 1: synthetic approac (r)- And (s)-Beta-Aryl-Gamma-Lactams. Adv synth catal, 357, 1849.

Date:

09-Mar-15 Release date: 20-Jan-16

Protein chain

Q02899  (OYE1_SACPS) -  NADPH dehydrogenase 1 from Saccharomyces pastorianus

Seq: 400 a.a.

Struc: 397 a.a.*

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

Enzyme reactions

• Enzyme class: E.C.1.6.99.1 - Nadph dehydrogenase.
• Reaction: A + NADPH + H⁺ = AH2 + NADP⁺
• Cofactor: FMN or FAD

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

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