MolNFT v1 · #185028 · protein
Burg (apo): biosynthesis of cyclopropanol rings in bacterial toxins
7PCE · Ketol-acid reductoisomerase: “Burg (apo): biosynthesis of cyclopropanol rings in bacterial toxins”. X-ray diffraction, 2 ligands (ADP, PO4), 2 pockets (best druggability 0.56). MolNFT v1 #185028 on GenesisL1: 3D structure, binding…
- PDB
- 7PCE
- Type
- protein
- Length
- 325 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Ketol-acid reductoisomerase
- EC
- 1.1.1.86
- UniProt
- Q2T3G7
- Ligands
- ADP, PO4
- Pockets
- 2 · best druggability 0.56
Structure
x-ray diffraction · 1 distinct chain · 59% helix, 12% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Ketol-acid reductoisomerase (EC 1.1.1.86) | protein | 325 | 59% helix, 12% strand | Q2T3G7 |
Ligands and binding sites
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
2 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 256 | 0.56 | 0.77 | 45 | ADP, PO4 |
| 2 | 221 | 0.45 | 0.72 | 31 | empty |
Compared structures
- 7PCE · BurG (apo): Biosynthesis of cyclopropanol rings in bacterial toxins · 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 Q2T3G7
- Elsewhere: RCSB PDB 7PCE · PDBe 7PCE · UniProt Q2T3G7
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