MolNFT v1 · #5623 · protein
Brassica napus enoyl acp REDUCTASE/NAD binary complex at pH 8.0 and room temperature
1ENO · Enoyl acyl carrier protein reductase: “Brassica napus enoyl acp REDUCTASE/NAD binary complex at pH 8.0 and room temperature”. X-ray diffraction, 1 ligand (NAD), 2 pockets (best druggability 0.64). MolNFT v1 #5623 on GenesisL1: 3D…
- PDB
- 1ENO
- Type
- protein
- Length
- 297 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Enoyl acyl carrier protein reductase
- EC
- 1.3.1.9
- UniProt
- P80030
- Ligands
- NAD
- Pockets
- 2 · best druggability 0.64
Structure
x-ray diffraction · 1 distinct chain · 46% helix, 16% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Enoyl acyl carrier protein reductase (EC 1.3.1.9) | protein | 297 | 46% helix, 16% strand | P80030 |
Ligands and binding sites
- NAD · Nicotinamide-adenine-dinucleotide · ligand · chains A
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 | 457 | 0.64 | 0.77 | 43 | NAD |
| 2 | 104 | 0.49 | 0.81 | 21 | empty |
Compared structures
- 1ENO · Brassica napus enoyl acp REDUCTASE/NAD binary complex at pH 8.0 and room temperature · the same entry in another collection · chain A against A, TM-score 1.00
- P80030 · AlphaFold monomer V2.0 prediction for enoyl-[acyl-carrier-protein] reductase [NADH]… · 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 P80030
- Elsewhere: RCSB PDB 1ENO · PDBe 1ENO · UniProt P80030
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