MolNFT v1 · #159743 · protein + RNA
Crystal structure of mus musculus (mm) endonuclease V in complex with a 23MER RNA oligo containing an inosine after a 15 min soak in 10 mm MG2+
6OZR: “Crystal structure of mus musculus (mm) endonuclease V in complex with a 23MER RNA oligo containing an inosine…”. X-ray diffraction, 2 ligands (MG, K), 3 pockets (best druggability 0.86). MolNFT v1 #159743 on GenesisL1: 3D structure…
- PDB
- 6OZR
- Type
- protein + RNA
- Length
- 521 residues
- Chains
- 4
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Endonuclease V; DNA/RNA (23-mer)
- EC
- 3.1.26.-
- UniProt
- Q8C9A2
- Ligands
- MG, K
- Pockets
- 3 · best druggability 0.86
Structure
x-ray diffraction · 3 distinct chains · 34% helix, 23% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Endonuclease V (EC 3.1.26.-) | protein | 243 | 34% helix, 23% strand | Q8C9A2 |
| B | Endonuclease V (EC 3.1.26.-) | protein | 248 | 34% helix, 23% strand | Q8C9A2 |
| C, D | DNA/RNA (23-mer) | rna | 15 | — | — |
Ligands and binding sites
- MG · Magnesium ion · metal · 4 copies · chains A, C, B, D
- K · Potassium ion · metal · 2 copies · chains A, C, B, D
- EDO · 1,2-ethanediol · additive · 4 copies · chains A, B
- TLA · L(+)-tartaric acid · additive · 3 copies · chains A, B
- GOL · Glycerol · additive · 2 copies · chains A
- PGE · Triethylene glycol · additive · 2 copies · chains A, B
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
3 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 957 | 0.86 | 0.88 | 49 | MG |
| 2 | 98 | 0.34 | 0.74 | 15 | empty |
| 3 | 67 | 0.29 | 0.73 | 14 | empty |
Interfaces
6 interfaces between chains.
- A–C · 819 Ų buried · 25 hydrogen bonds · protein-nucleic
- B–D · 785 Ų buried · 23 hydrogen bonds · protein-nucleic
- C–D · 599 Ų buried · 46 hydrogen bonds · nucleic-nucleic
- B–C · 424 Ų buried · 9 hydrogen bonds · protein-nucleic
- A–D · 399 Ų buried · 10 hydrogen bonds · protein-nucleic
Compared structures
- 6OZR · Crystal structure of Mus musculus (Mm) Endonuclease V in complex with a 23mer RNA oligo… · the same entry in another collection · chain A against A, TM-score 1.00
- Q8C9A2 · AlphaFold monomer V2.0 prediction for endonuclease V (Q8C9A2) · a predicted model of the same protein · chain B against A, TM-score 0.97
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 Q8C9A2
- Elsewhere: RCSB PDB 6OZR · PDBe 6OZR · UniProt Q8C9A2
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