MolNFT v1 · #96465 · protein
Open and closed forms of D1781E human PRP8 RNase H-like domain with bound mg ion
4JKH · Pre-mRNA-processing-splicing factor 8: “Open and closed forms of D1781E human PRP8 RNase H-like domain with bound mg ion”. X-ray diffraction, 2 ligands (MG, CL), 9 pockets (best druggability 0.64). MolNFT v1 #96465 on GenesisL1: 3D…
- PDB
- 4JKH
- Type
- protein
- Length
- 442 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Pre-mRNA-processing-splicing factor 8
- UniProt
- Q6P2Q9
- Ligands
- MG, CL
- Pockets
- 9 · best druggability 0.64
Structure
x-ray diffraction · 1 distinct chain · 43% helix, 20% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B | Pre-mRNA-processing-splicing factor 8 | protein | 221 | 43% helix, 20% strand | Q6P2Q9 |
Ligands and binding sites
- MG · Magnesium ion · metal · 2 copies · chains B, A
- CL · Chloride ion · ion · 4 copies · chains A, B
- GOL · Glycerol · additive · 2 copies · chains A, B
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
9 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 414 | 0.64 | 0.78 | 34 | GOL |
| 2 | 127 | 0.61 | 0.86 | 33 | MG |
| 3 | 254 | 0.54 | 0.76 | 24 | empty |
| 4 | 133 | 0.48 | 0.79 | 24 | empty |
| 5 | 115 | 0.45 | 0.78 | 24 | empty |
Interfaces
1 interface between chains.
- A–B · 987 Ų buried · 16 hydrogen bonds · protein-protein
Compared structures
- 4JKH · Open and closed forms of D1781E human PRP8 RNase H-like domain with bound Mg ion · 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 Q6P2Q9
- Elsewhere: RCSB PDB 4JKH · PDBe 4JKH · UniProt Q6P2Q9
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