MolNFT v1 · #76710 · protein
Crystal structure of staphylococcus epidermidis mevalonate diphosphate decarboxylase
3QT5: “Crystal structure of staphylococcus epidermidis mevalonate diphosphate decarboxylase”. X-ray diffraction, 3 pockets (best druggability 0.75). MolNFT v1 #76710 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 3QT5
- Type
- protein
- Length
- 649 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Mevalonate diphosphate decarboxylase
- EC
- 4.1.1.33
- UniProt
- Q9FD73
- Pockets
- 3 · best druggability 0.75
Structure
x-ray diffraction · 2 distinct chains · 42% helix, 26% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Mevalonate diphosphate decarboxylase (EC 4.1.1.33) | protein | 327 | 43% helix, 26% strand | Q9FD73 |
| B | Mevalonate diphosphate decarboxylase (EC 4.1.1.33) | protein | 322 | 41% helix, 26% strand | Q9FD73 |
Pockets
3 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 480 | 0.75 | 0.83 | 54 | empty |
| 2 | 430 | 0.68 | 0.80 | 58 | empty |
| 3 | 184 | 0.45 | 0.74 | 33 | empty |
Interfaces
1 interface between chains.
- A–B · 1007 Ų buried · 6 hydrogen bonds · protein-protein
Compared structures
- 3QT5 · Crystal structure of Staphylococcus epidermidis mevalonate diphosphate decarboxylase · 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 Q9FD73
- Elsewhere: RCSB PDB 3QT5 · PDBe 3QT5 · UniProt Q9FD73
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