MolNFT v1 · #107230 · protein
Crystal structure of the trans-acyltransferase polyketide synthase enoyl-isomerase
4U3V · Polyketide synthase pksr: “Crystal structure of the trans-acyltransferase polyketide synthase enoyl-isomerase”. X-ray diffraction, 3 pockets (best druggability 0.58). MolNFT v1 #107230 on GenesisL1: 3D structure, binding sites and…
- PDB
- 4U3V
- Type
- protein
- Length
- 242 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Polyketide synthase pksr
- EC
- 2.3.1.-
- UniProt
- O31784
- Pockets
- 3 · best druggability 0.58
Structure
x-ray diffraction · 1 distinct chain · 17% helix, 48% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Polyketide synthase pksr (EC 2.3.1.-) | protein | 242 | 17% helix, 48% strand | O31784 |
Pockets
3 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 122 | 0.58 | 0.84 | 25 | empty |
| 2 | 166 | 0.44 | 0.74 | 27 | empty |
| 3 | 100 | 0.40 | 0.76 | 17 | empty |
Compared structures
- 4U3V · Crystal structure of the trans-acyltransferase polyketide synthase enoyl-isomerase · the same entry in another collection · chain A against A, TM-score 1.00
- O31784 · AlphaFold monomer V2.0 prediction for polyketide synthase pksr (O31784) · a predicted model of the same protein · chain A against A, TM-score 0.97
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 O31784
- Elsewhere: RCSB PDB 4U3V · PDBe 4U3V · UniProt O31784
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