MolNFT v1 · #88364 · protein + RNA
Structural insights into toscana virus RNA encapsidation
4CSF · Nucleoprotein: “Structural insights into toscana virus RNA encapsidation”. X-ray diffraction, 20 pockets (best druggability 0.84). MolNFT v1 #88364 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 4CSF
- Type
- protein + RNA
- Length
- 6,085 residues
- Chains
- 36
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Nucleoprotein; RNA (5'-R(*UP*GP*UP*GP*UP*UP*UP*CP*UP)-3')
- UniProt
- P21701
- Pockets
- 20 · best druggability 0.84
Structure
x-ray diffraction · 9 distinct chains · 69% helix, 2% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B, D, F, G, H, I, J, N, P, Q, S, V | Nucleoprotein | protein | 249 | 71% helix, 2% strand | P21701 |
| C | Nucleoprotein | protein | 250 | 70% helix, 2% strand | P21701 |
| E | Nucleoprotein | protein | 249 | 69% helix, 2% strand | P21701 |
| K | Nucleoprotein | protein | 251 | 65% helix, 2% strand | P21701 |
| L, T, W | Nucleoprotein | protein | 250 | 71% helix, 1% strand | P21701 |
| M, O, R | Nucleoprotein | protein | 248 | 67% helix, 2% strand | P21701 |
| U | Nucleoprotein | protein | 247 | 69% helix, 2% strand | P21701 |
| X | Nucleoprotein | protein | 249 | 67% helix, 1% strand | P21701 |
| a, c, e, g, i, k, m, o, q, s, u, w | RNA (5'-R(*UP*GP*UP*GP*UP*UP*UP*CP*UP)-3') | rna | 9 | — | — |
Pockets
20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 1095 | 0.84 | 0.85 | 113 | empty |
| 2 | 1089 | 0.84 | 0.85 | 111 | empty |
| 3 | 1091 | 0.83 | 0.85 | 112 | empty |
| 4 | 1055 | 0.81 | 0.82 | 93 | empty |
| 5 | 1050 | 0.80 | 0.81 | 89 | empty |
Interfaces
82 interfaces between chains.
- H–I · 2064 Ų buried · 22 hydrogen bonds · protein-protein
- V–W · 2061 Ų buried · 25 hydrogen bonds · protein-protein
- J–K · 2036 Ų buried · 21 hydrogen bonds · protein-protein
- B–C · 2034 Ų buried · 22 hydrogen bonds · protein-protein
- T–U · 2026 Ų buried · 24 hydrogen bonds · protein-protein
Compared structures
- 4CSF · Structural insights into Toscana virus RNA encapsidation · the same entry in another collection · chain k against k, 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 P21701
- Elsewhere: RCSB PDB 4CSF · PDBe 4CSF · UniProt P21701
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