MolNFT v1 · #77550 · protein
X-ray structure of the C-terminal swapped dimer of P114A variant of ribonuclease a
3RID · Ribonuclease pancreatic: “X-ray structure of the C-terminal swapped dimer of P114A variant of ribonuclease a”. X-ray diffraction, 2 ligands (CGP, PO4), 1 pocket (best druggability 0.35). MolNFT v1 #77550 on GenesisL1: 3D structure…
- PDB
- 3RID
- Type
- protein
- Length
- 496 residues
- Chains
- 4
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Ribonuclease pancreatic
- EC
- 3.1.27.5
- UniProt
- P61823
- Ligands
- CGP, PO4
- Pockets
- 1 · best druggability 0.35
Structure
x-ray diffraction · 1 distinct chain · 21% helix, 39% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B, C, D | Ribonuclease pancreatic (EC 3.1.27.5) | protein | 124 | 21% helix, 39% strand | P61823 |
Ligands and binding sites
- CGP · 2'-deoxycytidine-2'-deoxyguanosine-3',5'-monophosphate · ligand · 4 copies · chains A, B, C, D
- PO4 · Phosphate ion · ion · 4 copies · chains A, B, C, D
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 95 | 0.35 | 0.74 | 25 | empty |
Interfaces
3 interfaces between chains.
- C–D · 1889 Ų buried · 38 hydrogen bonds · protein-protein
- A–B · 1859 Ų buried · 37 hydrogen bonds · protein-protein
- B–D · 99 Ų buried · 1 hydrogen bond · protein-protein
Modifications
Observed in the structure: 16 disulfide (disulfide).
Compared structures
- 3RID · X-ray structure of the C-terminal swapped dimer of P114A variant of Ribonuclease A · 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 P61823
- Elsewhere: RCSB PDB 3RID · PDBe 3RID · UniProt P61823
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