MolNFT v1 · #91819 · protein
S-formylglutathione hydrolase variant H160I
4FOL: “S-formylglutathione hydrolase variant H160I”. X-ray diffraction, 6 pockets (best druggability 0.63). MolNFT v1 #91819 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 4FOL
- Type
- protein
- Length
- 1,130 residues
- Chains
- 4
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- S-formylglutathione hydrolase
- EC
- 3.1.2.12
- UniProt
- P40363
- Pockets
- 6 · best druggability 0.63
Structure
x-ray diffraction · 4 distinct chains · 37% helix, 24% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | S-formylglutathione hydrolase (EC 3.1.2.12) | protein | 283 | 38% helix, 23% strand | P40363 |
| B | S-formylglutathione hydrolase (EC 3.1.2.12) | protein | 283 | 38% helix, 25% strand | P40363 |
| C | S-formylglutathione hydrolase (EC 3.1.2.12) | protein | 282 | 36% helix, 23% strand | P40363 |
| D | S-formylglutathione hydrolase (EC 3.1.2.12) | protein | 282 | 37% helix, 24% strand | P40363 |
Pockets
6 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 285 | 0.63 | 0.80 | 49 | empty |
| 2 | 79 | 0.53 | 0.85 | 19 | empty |
| 3 | 180 | 0.51 | 0.77 | 30 | empty |
| 4 | 187 | 0.51 | 0.77 | 27 | empty |
| 5 | 163 | 0.48 | 0.77 | 28 | empty |
Interfaces
4 interfaces between chains.
- C–D · 941 Ų buried · 3 hydrogen bonds · protein-protein
- A–B · 900 Ų buried · 4 hydrogen bonds · protein-protein
- B–D · 308 Ų buried · 11 hydrogen bonds · protein-protein
- A–C · 307 Ų buried · 9 hydrogen bonds · protein-protein
Compared structures
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 P40363
- Elsewhere: RCSB PDB 4FOL · PDBe 4FOL · UniProt P40363
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