MolNFT v1 · #122498 · protein
1.05A resolution structure of holo hasap (R33A) from pseudomonas aeruginosa
5IQX · Heme acquisition protein hasap: “1.05A resolution structure of holo hasap (R33A) from pseudomonas aeruginosa”. X-ray diffraction, 3 ligands (HEM, MLT, NA), 1 pocket (best druggability 0.55). MolNFT v1 #122498 on GenesisL1: 3D…
- PDB
- 5IQX
- Type
- protein
- Length
- 182 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Heme acquisition protein hasap
- UniProt
- G3XD33
- Ligands
- HEM, MLT, NA
- Pockets
- 1 · best druggability 0.55
Structure
x-ray diffraction · 1 distinct chain · 30% helix, 36% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Heme acquisition protein hasap | protein | 182 | 30% helix, 36% strand | G3XD33 |
Ligands and binding sites
- HEM · Protoporphyrin IX containing Fe · ligand · chains A
- MLT · D-malate · ligand · chains A
- NA · Sodium ion · metal · 4 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 | 126 | 0.55 | 0.82 | 22 | HEM |
Compared structures
- 5IQX · 1.05A resolution structure of Holo HasAp (R33A) from Pseudomonas aeruginosa · 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 G3XD33
- Elsewhere: RCSB PDB 5IQX · PDBe 5IQX · UniProt G3XD33
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