MolNFT v1 · #187315 · protein
Structure of the malate racemase MAR2 apoprotein from thermoanaerobacterium thermosaccharolyticum at 2.25 ångströms resolution
7S91: “Structure of the malate racemase MAR2 apoprotein from thermoanaerobacterium thermosaccharolyticum at 2.25…”. X-ray diffraction, 1 ligand (CL), 2 pockets (best druggability 0.72). MolNFT v1 #187315 on GenesisL1: 3D structure, binding…
- PDB
- 7S91
- Type
- protein
- Length
- 401 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Malate racemase MAR2
- UniProt
- D9TSN9
- Ligands
- CL
- Pockets
- 2 · best druggability 0.72
Structure
x-ray diffraction · 1 distinct chain · 36% helix, 27% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Malate racemase MAR2 | protein | 401 | 36% helix, 27% strand | D9TSN9 |
Ligands and binding sites
- CL · Chloride ion · ion · 2 copies · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
2 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 695 | 0.72 | 0.79 | 60 | empty |
| 2 | 78 | 0.33 | 0.74 | 19 | empty |
Compared structures
- 7S91 · Structure of the malate racemase mar2 apoprotein from Thermoanaerobacterium… · 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 D9TSN9
- Elsewhere: RCSB PDB 7S91 · PDBe 7S91 · UniProt D9TSN9
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