MolNFT v1 · #53806 · protein
Crystal structure of T. maritima GDP-mannose pyrophosphorylase in complex with GDP-mannose.
2X5Z · Mannose-1-phosphate guanylyltransferase: “Crystal structure of T. maritima GDP-mannose pyrophosphorylase in complex with GDP-mannose.”. X-ray diffraction, 2 ligands (GDD, MG), 6 pockets (best druggability 0.73). MolNFT v1 #53806 on…
- PDB
- 2X5Z
- Type
- protein
- Length
- 666 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Mannose-1-phosphate guanylyltransferase
- EC
- 2.7.7.13
- UniProt
- Q9X0C3
- Ligands
- GDD, MG
- Pockets
- 6 · best druggability 0.73
Structure
x-ray diffraction · 1 distinct chain · 38% helix, 28% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B | Mannose-1-phosphate guanylyltransferase (EC 2.7.7.13) | protein | 333 | 38% helix, 28% strand | Q9X0C3 |
Ligands and binding sites
- GDD · Guanosine-5'-diphosphate-alpha-D-mannose · ligand · 2 copies · chains A, B
- MG · Magnesium ion · metal · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
6 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 650 | 0.73 | 0.80 | 68 | GDD, MG |
| 2 | 603 | 0.72 | 0.80 | 55 | GDD |
| 3 | 57 | 0.42 | 0.82 | 17 | empty |
| 4 | 101 | 0.39 | 0.76 | 19 | empty |
| 5 | 56 | 0.36 | 0.79 | 12 | empty |
Interfaces
1 interface between chains.
- A–B · 1402 Ų buried · 22 hydrogen bonds · protein-protein
Compared structures
- 2X5Z · Crystal structure of T. maritima GDP-mannose pyrophosphorylase in complex with… · 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 Q9X0C3
- Elsewhere: RCSB PDB 2X5Z · PDBe 2X5Z · UniProt Q9X0C3
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