MolNFT v1 · #2490 · protein
Fhua from E. COLI
1BY3 · Protein (ferrichrome-iron receptor precursor (fhua)): “Fhua from E. COLI”. X-ray diffraction, 1 ligand (OES), 6 pockets (best druggability 0.87). MolNFT v1 #2490 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 1BY3
- Type
- protein
- Length
- 695 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Protein (ferrichrome-iron receptor precursor (fhua))
- UniProt
- P06971
- Ligands
- OES
- Pockets
- 6 · best druggability 0.87
Structure
x-ray diffraction · 1 distinct chain · 6% helix, 56% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Protein (ferrichrome-iron receptor precursor (fhua)) | protein | 695 | 6% helix, 56% strand | P06971 |
Ligands and binding sites
- OES · N-octyl-2-hydroxyethyl sulfoxide · ligand · 7 copies · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
6 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 1200 | 0.87 | 0.88 | 171 | empty |
| 2 | 65 | 0.73 | 0.98 | 24 | empty |
| 3 | 173 | 0.69 | 0.88 | 34 | empty |
| 4 | 110 | 0.63 | 0.88 | 28 | OES |
| 5 | 413 | 0.63 | 0.78 | 43 | empty |
Modifications
Observed in the structure: 2 disulfide (disulfide).
Compared structures
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 P06971
- Elsewhere: RCSB PDB 1BY3 · PDBe 1BY3 · UniProt P06971
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