MolNFT v1 · #100918 · protein
Crystal structure of 3-oxoacyl-[acyl-carrier protein] reductase from brucella melitensis atcc 23457
4NBR · Hypothetical 3-oxoacyl-(acyl-carrier protein) reductase: “Crystal structure of 3-oxoacyl-[acyl-carrier protein] reductase from brucella melitensis atcc 23457”. X-ray diffraction, 3 pockets (best druggability 0.71). MolNFT v1 #100918…
- PDB
- 4NBR
- Type
- protein
- Length
- 268 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Hypothetical 3-oxoacyl-(acyl-carrier protein) reductase
- UniProt
- Q577I6
- Pockets
- 3 · best druggability 0.71
Structure
x-ray diffraction · 1 distinct chain · 47% helix, 15% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Hypothetical 3-oxoacyl-(acyl-carrier protein) reductase | protein | 268 | 47% helix, 15% strand | Q577I6 |
Ligands and binding sites
- GOL · Glycerol · additive · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
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 | 469 | 0.71 | 0.81 | 46 | GOL |
| 2 | 120 | 0.40 | 0.75 | 25 | empty |
| 3 | 51 | 0.27 | 0.74 | 15 | empty |
Compared structures
- 4NBR · Crystal Structure of 3-oxoacyl-[acyl-carrier protein] reductase from Brucella melitensis… · 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 Q577I6
- Elsewhere: RCSB PDB 4NBR · PDBe 4NBR · UniProt Q577I6
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