MolNFT v1 · #138085 · protein
Toxoplasma gondii CDPK1 in complex with inhibitor gxj-237
5W80: “Toxoplasma gondii CDPK1 in complex with inhibitor gxj-237”. X-ray diffraction, 2 ligands (9XJ, CA). MolNFT v1 #138085 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 5W80
- Type
- protein
- Length
- 453 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- Q9BJF5
- Ligands
- 9XJ, CA
Structure
x-ray diffraction · 1 distinct chain.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 453 | — | Q9BJF5 |
Ligands and binding sites
- 9XJ · 3-(3-chlorophenoxy)-1-[(piperidin-4-yl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine · ligand · chains A
- CA · Calcium ion · metal · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 5W80 · Toxoplasma Gondii CDPK1 in complex with inhibitor GXJ-237 · 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 Q9BJF5
- Elsewhere: RCSB PDB 5W80 · PDBe 5W80 · UniProt Q9BJF5
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