MolNFT v1 · #71123 · protein
Entamoeba histolytica asparaginyl-tRNA synthetase (asnrs)
3M4Q · Asparaginyl-tRNA synthetase, putative: “Entamoeba histolytica asparaginyl-tRNA synthetase (asnrs)”. X-ray diffraction, 8 pockets (best druggability 0.75). MolNFT v1 #71123 on GenesisL1: 3D structure, binding sites and pockets in…
- PDB
- 3M4Q
- Type
- protein
- Length
- 866 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Asparaginyl-tRNA synthetase, putative
- EC
- 6.1.1.22
- UniProt
- C4LWW8
- Pockets
- 8 · best druggability 0.75
Structure
x-ray diffraction · 2 distinct chains · 32% helix, 29% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Asparaginyl-tRNA synthetase, putative (EC 6.1.1.22) | protein | 429 | 33% helix, 29% strand | C4LWW8 |
| B | Asparaginyl-tRNA synthetase, putative (EC 6.1.1.22) | protein | 437 | 31% helix, 28% strand | C4LWW8 |
Pockets
8 pockets found on a 1 Å grid, 7 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 694 | 0.75 | 0.81 | 76 | empty |
| 2 | 72 | 0.73 | 0.97 | 30 | empty |
| 3 | 572 | 0.67 | 0.77 | 68 | empty |
| 4 | 426 | 0.65 | 0.78 | 41 | empty |
| 5 | 405 | 0.63 | 0.77 | 46 | empty |
Interfaces
1 interface between chains.
- A–B · 4052 Ų buried · 76 hydrogen bonds · protein-protein
Compared structures
- 3M4Q · Entamoeba histolytica asparaginyl-tRNA synthetase (AsnRS) · 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 C4LWW8
- Elsewhere: RCSB PDB 3M4Q · PDBe 3M4Q · UniProt C4LWW8
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