MolNFT v1 · #30739 · protein
Crystal structure of a pantothenate synthetase, apo enzyme in C2 space group
2A88 · Pantoate--beta-alanine ligase: “Crystal structure of a pantothenate synthetase, apo enzyme in C2 space group”. X-ray diffraction, 1 ligand (SO4), 1 pocket (best druggability 0.79). MolNFT v1 #30739 on GenesisL1: 3D structure…
- PDB
- 2A88
- Type
- protein
- Length
- 276 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Pantoate--beta-alanine ligase
- EC
- 6.3.2.1
- UniProt
- P0A5R0
- Ligands
- SO4
- Pockets
- 1 · best druggability 0.79
Structure
x-ray diffraction · 1 distinct chain · 41% helix, 22% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Pantoate--beta-alanine ligase (EC 6.3.2.1) | protein | 276 | 41% helix, 22% strand | P0A5R0 |
Ligands and binding sites
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 601 | 0.79 | 0.84 | 68 | SO4 |
Compared structures
- 2A88 · Crystal structure of A Pantothenate synthetase, apo enzyme in C2 space group · 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 P0A5R0
- Elsewhere: RCSB PDB 2A88 · PDBe 2A88 · UniProt P0A5R0
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