MolNFT v1 · #54632 · protein
Crystal structure of the triscatecholate siderophore binding protein feua from bacillus subtilis complexed with ferric mecam
2XV1 · Iron-uptake system-binding protein: “Crystal structure of the triscatecholate siderophore binding protein feua from bacillus subtilis complexed…”. X-ray diffraction, 3 ligands (ECA, FE, PO4), 1 pocket (best druggability 0.53).…
- PDB
- 2XV1
- Type
- protein
- Length
- 283 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Iron-uptake system-binding protein
- UniProt
- P40409
- Ligands
- ECA, FE, PO4
- Pockets
- 1 · best druggability 0.53
Structure
x-ray diffraction · 1 distinct chain · 40% helix, 20% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Iron-uptake system-binding protein | protein | 283 | 40% helix, 20% strand | P40409 |
Ligands and binding sites
- ECA · N,N',N''-[benzene-1,3,5-triyltris(methylene)]tris(2,3-dihydroxybenzamide) · ligand · chains A
- FE · Fe (III) ion · metal · chains A
- PO4 · Phosphate ion · ion · 2 copies · chains A
- PEG · Di(hydroxyethyl)ether · additive · 2 copies · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 174 | 0.53 | 0.79 | 29 | ECA, FE |
Compared structures
- 2XV1 · Crystal structure of the triscatecholate siderophore binding protein FeuA from Bacillus… · the same entry in another collection · chain A against A, TM-score 1.00
- P40409 · AlphaFold monomer V2.0 prediction for iron-uptake system-binding protein (P40409) · a predicted model of the same protein · chain A against A, TM-score 0.96
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 P40409
- Elsewhere: RCSB PDB 2XV1 · PDBe 2XV1 · UniProt P40409
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