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MolNFT v1 · #186867 · protein

1.80 a resolution structure of mao from P. nicotinovorans in complex with FAD

7RT0 · 4-methylaminobutanoate oxidase (methylamine-forming): “1.80 a resolution structure of mao from P. nicotinovorans in complex with FAD”. X-ray diffraction, 1 ligand (FAD), 2 pockets (best druggability 0.78). MolNFT v1 #186867 on…

PDB
7RT0
Type
protein
Length
385 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
4-methylaminobutanoate oxidase (methylamine-forming)
EC
1.5.3.21
UniProt
Q8GAJ0
Ligands
FAD
Pockets
2 · best druggability 0.78

Structure

x-ray diffraction · 1 distinct chain · 34% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A4-methylaminobutanoate oxidase (methylamine-forming) (EC 1.5.3.21)protein38534% helix, 26% strandQ8GAJ0

Ligands and binding sites

  • FAD · Flavin-adenine dinucleotide · ligand · chains A
  • PG4 · Tetraethylene glycol · additive · chains A

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

Pockets

2 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17110.780.8273FAD
2570.560.9017empty

Compared structures

  • 7RT0 · 1.80 A resolution structure of MAO from P. nicotinovorans in complex with FAD · the same entry in another collection · chain A against A, TM-score 1.00
  • Q8GAJ0 · AlphaFold monomer V2.0 prediction for 4-methylaminobutanoate oxidase… · a predicted model of the same protein · chain A against A, TM-score 0.98

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