MolNFT v1 · #111812 · protein
Structure of factor inhibiting hif (fih) in complex with fe, no, and nog
4Z1V · Hypoxia-inducible factor 1-alpha inhibitor: “Structure of factor inhibiting hif (fih) in complex with fe, no, and nog”. X-ray diffraction, 4 ligands (OGA, FE, SO4), 4 pockets (best druggability 0.63). MolNFT v1 #111812 on GenesisL1…
- PDB
- 4Z1V
- Type
- protein
- Length
- 341 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Hypoxia-inducible factor 1-alpha inhibitor
- EC
- 1.14.11.30, 1.14.11.-
- UniProt
- Q9NWT6
- Ligands
- OGA, FE, SO4, NO
- Pockets
- 4 · best druggability 0.63
Structure
x-ray diffraction · 1 distinct chain · 30% helix, 25% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Hypoxia-inducible factor 1-alpha inhibitor (EC 1.14.11.30, 1.14.11.-) | protein | 341 | 30% helix, 25% strand | Q9NWT6 |
Ligands and binding sites
- OGA · N-oxalylglycine · ligand · chains A
- FE · Fe (III) ion · metal · chains A
- SO4 · Sulfate ion · ion · 5 copies · chains A
- NO · Nitric oxide · ion · chains A
- PEG · Di(hydroxyethyl)ether · additive · 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 | 384 | 0.63 | 0.78 | 36 | OGA, NO, PEG, FE |
| 2 | 80 | 0.46 | 0.81 | 23 | empty |
| 3 | 134 | 0.41 | 0.75 | 23 | empty |
| 4 | 85 | 0.38 | 0.76 | 21 | empty |
Compared structures
- 4Z1V · Structure of Factor Inhibiting HIF (FIH) in complex with Fe, NO, and NOG · the same entry in another collection · chain A against A, TM-score 1.00
- Q9NWT6 · AlphaFold monomer V2.0 prediction for hypoxia-inducible factor 1-alpha inhibitor (Q9NWT6) · a predicted model of the same protein · chain A against A, TM-score 0.95
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 Q9NWT6
- Elsewhere: RCSB PDB 4Z1V · PDBe 4Z1V · UniProt Q9NWT6
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