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MolNFT v2 · #179654 · protein

Crystal structure of KRED F147L/L153Q/Y190P/L199A/M205F/M206F variant and methyl methacrylate complex

7EJI: “Crystal structure of KRED F147L/L153Q/Y190P/L199A/M205F/M206F variant and methyl methacrylate complex”. X-ray diffraction at 1.56002, 4 ligands (NAP, J66, J69). MolNFT v2 #179654 on GenesisL1: 3D structure, binding sites and pockets…

PDB
7EJI
Type
protein
Length
1,007 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
1.56002
Source
Lactobacillus kefiri
UniProt
Q6WVP7
Ligands
NAP, J66, J69, MG

Structure

x-ray diffraction · resolution 1.56002 · 3 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein253—Q6WVP7
B, C—protein251—Q6WVP7
D—protein252—Q6WVP7

Ligands and binding sites

  • NAP · Nadp nicotinamide-adenine-dinucleotide phosphate · ligand · 4 copies · chains A, B, C, D
  • J66 · 2-oxidanylisoindole-1,3-dione · ligand · 2 copies · chains A, C
  • J69 · methyl 2-methylprop-2-enoate · ligand · 2 copies · chains B, D
  • MG · Magnesium ion · metal · 2 copies · chains A, B, C, D
  • GOL · Glycerol · additive · 3 copies · chains A, B, C, D
  • EDO · 1,2-ethanediol · additive · 3 copies · chains A, C, D, B
  • BTB · 2-[bis-(2-hydroxy-ethyl)-amino]-2-hydroxymethyl-propane-1,3-diol · additive · 2 copies · chains A, D, B, C
  • PEG · Di(hydroxyethyl)ether · additive · chains B, C

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

  • 7EJI · Crystal structure of kred F147L/L153Q/Y190P/L199A/M205F/M206F variant and methyl… · the same entry in another collection · chain A against A, TM-score 1.00

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