MolNFT v1 · #126786 · protein
The structure of the mature HIV-1 ca hexameric lattice with curvature parameters: TILT=17, TWIST=0
5MDA · Gag protein: “The structure of the mature HIV-1 ca hexameric lattice with curvature parameters: TILT=17, TWIST=0”. Electron microscopy, 14 pockets (best druggability 0.38). MolNFT v1 #126786 on GenesisL1: 3D structure, binding sites…
- PDB
- 5MDA
- Type
- protein
- Length
- 1,474 residues
- Chains
- 14
- Method
- electron microscopy
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Gag protein
- UniProt
- A0A0K0V8J8, E9MJT0
- Pockets
- 14 · best druggability 0.38
Structure
electron microscopy · 2 distinct chains · 60% helix, 3% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B, F, W, C, D, E, G | Gag protein | protein | 74 | 64% helix, 0% strand | A0A0K0V8J8 |
| a, b, f, H, I, J | Gag protein | protein | 147 | 58% helix, 4% strand | E9MJT0 |
Pockets
14 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 166 | 0.38 | 0.72 | 37 | empty |
| 2 | 126 | 0.34 | 0.72 | 31 | empty |
| 3 | 96 | 0.31 | 0.73 | 21 | empty |
| 4 | 93 | 0.30 | 0.73 | 24 | empty |
| 5 | 86 | 0.29 | 0.72 | 23 | empty |
Interfaces
14 interfaces between chains.
- C–H · 63 Ų buried · 1 hydrogen bond · protein-protein
- A–a · 63 Ų buried · 1 hydrogen bond · protein-protein
- B–b · 59 Ų buried · 1 hydrogen bond · protein-protein
- E–J · 58 Ų buried · 1 hydrogen bond · protein-protein
- D–I · 58 Ų buried · 1 hydrogen bond · protein-protein
Compared structures
- 5MDA · The structure of the mature HIV-1 CA hexameric lattice with curvature parameters… · 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 A0A0K0V8J8
- Every structure of UniProt E9MJT0
- Elsewhere: RCSB PDB 5MDA · PDBe 5MDA · UniProt A0A0K0V8J8 · UniProt E9MJT0
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