MolNFT v1 · #174629 · protein
Crystal structure of histidine-containing phosphotransfer protein B (hptb) from pseudomonas aeruginosa PAO1
7C1I · Histidine kinase: “Crystal structure of histidine-containing phosphotransfer protein B (hptb) from pseudomonas aeruginosa PAO1”. X-ray diffraction, 10 pockets (best druggability 0.56). MolNFT v1 #174629 on GenesisL1: 3D structure…
- PDB
- 7C1I
- Type
- protein
- Length
- 690 residues
- Chains
- 6
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Histidine kinase
- UniProt
- A0A2V3FJP9
- Pockets
- 10 · best druggability 0.56
Structure
x-ray diffraction · 1 distinct chain · 81% helix, 0% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B, C, D, E, F | Histidine kinase | protein | 115 | 81% helix, 0% strand | A0A2V3FJP9 |
Pockets
10 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 404 | 0.56 | 0.74 | 40 | empty |
| 2 | 129 | 0.41 | 0.75 | 21 | empty |
| 3 | 99 | 0.40 | 0.76 | 14 | empty |
| 4 | 124 | 0.39 | 0.74 | 19 | empty |
| 5 | 116 | 0.37 | 0.74 | 17 | empty |
Interfaces
8 interfaces between chains.
- D–E · 452 Ų buried · 5 hydrogen bonds · protein-protein
- A–C · 445 Ų buried · 4 hydrogen bonds · protein-protein
- A–B · 437 Ų buried · 3 hydrogen bonds · protein-protein
- B–C · 436 Ų buried · 3 hydrogen bonds · protein-protein
- E–F · 435 Ų buried · 3 hydrogen bonds · protein-protein
Compared structures
- 7C1I · Crystal structure of histidine-containing phosphotransfer protein B (HptB) from… · 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 A0A2V3FJP9
- Elsewhere: RCSB PDB 7C1I · PDBe 7C1I · UniProt A0A2V3FJP9
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