MolNFT v1 · #45157 · protein
Muconate cycloisomerase variant F329I
2MUC · Protein (muconate cycloisomerase): “Muconate cycloisomerase variant F329I”. X-ray diffraction, 1 ligand (MN), 4 pockets (best druggability 0.80). MolNFT v1 #45157 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 2MUC
- Type
- protein
- Length
- 720 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Protein (muconate cycloisomerase)
- EC
- 5.5.1.1
- UniProt
- P08310
- Ligands
- MN
- Pockets
- 4 · best druggability 0.80
Structure
x-ray diffraction · 1 distinct chain · 43% helix, 21% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B | Protein (muconate cycloisomerase) (EC 5.5.1.1) | protein | 360 | 43% helix, 21% strand | P08310 |
Ligands and binding sites
- MN · Manganese (II) ion · metal · 2 copies · chains A, B
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
4 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 958 | 0.80 | 0.82 | 96 | empty |
| 2 | 258 | 0.59 | 0.79 | 39 | empty |
| 3 | 189 | 0.59 | 0.81 | 35 | empty |
| 4 | 56 | 0.28 | 0.74 | 18 | empty |
Interfaces
1 interface between chains.
- A–B · 916 Ų buried · 10 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 P08310
- Elsewhere: RCSB PDB 2MUC · PDBe 2MUC · UniProt P08310
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