MolNFT v1 · #47008 · protein
Nikd, an unusual amino acid oxidase essential for nikkomycin biosynthesis: open form at 1.9A resolution
2OLO · Nikd protein: “Nikd, an unusual amino acid oxidase essential for nikkomycin biosynthesis: open form at 1.9A resolution”. X-ray diffraction, 2 ligands (FAD, 6PC), 4 pockets (best druggability 0.85). MolNFT v1 #47008 on GenesisL1: 3D…
- PDB
- 2OLO
- Type
- protein
- Length
- 393 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Nikd protein
- UniProt
- Q9X9P9
- Ligands
- FAD, 6PC
- Pockets
- 4 · best druggability 0.85
Structure
x-ray diffraction · 1 distinct chain · 30% helix, 30% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Nikd protein | protein | 393 | 30% helix, 30% strand | Q9X9P9 |
Ligands and binding sites
- FAD · Flavin-adenine dinucleotide · ligand · chains A
- 6PC · Pyridine-2-carboxylic acid · ligand · chains A
- MPD · (4S)-2-methyl-2,4-pentanediol · additive · 2 copies · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
4 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 835 | 0.85 | 0.87 | 97 | FAD, 6PC, MPD |
| 2 | 67 | 0.43 | 0.81 | 12 | empty |
| 3 | 60 | 0.30 | 0.75 | 14 | empty |
| 4 | 54 | 0.28 | 0.74 | 18 | empty |
Modifications
Observed in the structure: 1 cofactor (flavinylation).
Compared structures
- 2OLO · NikD, an unusual amino acid oxidase essential for nikkomycin biosynthesis: open form at… · 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 Q9X9P9
- Elsewhere: RCSB PDB 2OLO · PDBe 2OLO · UniProt Q9X9P9
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