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).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Molybdenum cofactor biosynthesis protein a | protein | 327 | 36% helix, 18% strand | Q99S04 |
| B | Molybdenum cofactor biosynthesis protein a | protein | 326 | 36% helix, 19% strand | Q99S04 |
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.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 1099 | 0.82 | 0.83 | 98 | SO4, SF4 |
| 2 | 572 | 0.82 | 0.87 | 76 | empty |
| 3 | 1153 | 0.81 | 0.82 | 86 | SO4, SF4 |
| 4 | 80 | 0.31 | 0.73 | 19 | empty |
| 5 | 73 | 0.30 | 0.73 | 19 | empty |
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
Analyse
- Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
- Every structure of UniProt Q99S04
- Elsewhere: RCSB PDB 1TV7 · PDBe 1TV7 · UniProt Q99S04
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