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MolNFT v1 · #23272 · protein

Structure of the S-adenosylmethionine dependent enzyme moaa

1TV7 · Molybdenum cofactor biosynthesis protein a: “Structure of the S-adenosylmethionine dependent enzyme moaa”. X-ray diffraction, 2 ligands (SF4, SO4), 5 pockets (best druggability 0.82). MolNFT v1 #23272 on GenesisL1: 3D structure…

PDB
1TV7
Type
protein
Length
653 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Molybdenum cofactor biosynthesis protein a
UniProt
Q99S04
Ligands
SF4, SO4
Pockets
5 · best druggability 0.82

Structure

x-ray diffraction · 2 distinct chains · 36% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMolybdenum cofactor biosynthesis protein aprotein32736% helix, 18% strandQ99S04
BMolybdenum cofactor biosynthesis protein aprotein32636% helix, 19% strandQ99S04

Ligands and binding sites

  • SF4 · Iron/sulfur cluster · ligand · 4 copies · chains A, B
  • SO4 · Sulfate ion · ion · 2 copies · chains A, B

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

Pockets

5 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110990.820.8398SO4, SF4
25720.820.8776empty
311530.810.8286SO4, SF4
4800.310.7319empty
5730.300.7319empty

Interfaces

1 interface between chains.

  • A–B · 1491 Ų buried · 17 hydrogen bonds · protein-protein

Compared structures

  • 1TV7 · Structure of the S-adenosylmethionine dependent Enzyme MoaA · the same entry in another collection · chain A against A, TM-score 1.00

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