MolNFT v1 · #24446 · protein + RNA
The structural basis for RNA specificity and CA2 inhibition of an RNA- dependent RNA polymerase PHI6P2 with 7NT RNA
1UVJ · RNA-directed RNA polymerase: “The structural basis for RNA specificity and CA2 inhibition of an RNA- dependent RNA polymerase PHI6P2 with…”. X-ray diffraction, 1 ligand (MN), 12 pockets (best druggability 0.85). MolNFT v1 #24446 on…
- PDB
- 1UVJ
- Type
- protein + RNA
- Length
- 2,004 residues
- Chains
- 6
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- RNA-directed RNA polymerase; 5'-R(*UP*UP*CP*CP)-3'
- EC
- 2.7.7.48
- UniProt
- P11124
- Ligands
- MN
- Pockets
- 12 · best druggability 0.85
Structure
x-ray diffraction · 2 distinct chains · 45% helix, 15% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B, C | RNA-directed RNA polymerase (EC 2.7.7.48) | protein | 664 | 45% helix, 15% strand | P11124 |
| D, E, F | 5'-R(*UP*UP*CP*CP)-3' | rna | 4 | — | — |
Ligands and binding sites
- MN · Manganese (II) ion · metal · 3 copies · chains A, B, C
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
12 pockets found on a 1 Å grid, 10 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 771 | 0.85 | 0.88 | 106 | empty |
| 2 | 1026 | 0.85 | 0.86 | 94 | empty |
| 3 | 445 | 0.79 | 0.87 | 53 | empty |
| 4 | 415 | 0.77 | 0.86 | 49 | empty |
| 5 | 187 | 0.76 | 0.92 | 39 | empty |
Interfaces
5 interfaces between chains.
- A–B · 895 Ų buried · 10 hydrogen bonds · protein-protein
- A–D · 889 Ų buried · 20 hydrogen bonds · protein-nucleic
- C–F · 886 Ų buried · 18 hydrogen bonds · protein-nucleic
- B–E · 883 Ų buried · 20 hydrogen bonds · protein-nucleic
- A–C · 471 Ų buried · 4 hydrogen bonds · protein-protein
Compared structures
- 1UVJ · The structural basis for RNA specificity and Ca2 inhibition of an RNA-dependent RNA… · 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 P11124
- Elsewhere: RCSB PDB 1UVJ · PDBe 1UVJ · UniProt P11124
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