MolNFT v1 · #178947 · protein
Crystal structure of the R64D mutant of bauhinia bauhinioides kallikrein inhibitor complexed with human kallikrein 4
7JQO: “Crystal structure of the R64D mutant of bauhinia bauhinioides kallikrein inhibitor complexed with human…”. X-ray diffraction, 3 ligands (CD, CL, SO4). MolNFT v1 #178947 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 7JQO
- Type
- protein
- Length
- 389 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- Q9Y5K2, Q6VEQ7
- Ligands
- CD, CL, SO4
Structure
x-ray diffraction · 2 distinct chains.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| E | — | protein | 223 | — | Q9Y5K2 |
| I | — | protein | 166 | — | Q6VEQ7 |
Ligands and binding sites
- CD · Cadmium ion · metal · chains E
- CL · Chloride ion · ion · 2 copies · chains I
- SO4 · Sulfate ion · ion · chains I
- 2PE · Nonaethylene glycol · additive · 3 copies · chains E, I
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 7JQO · Crystal structure of the R64D mutant of Bauhinia Bauhinioides Kallikrein Inhibitor… · the same entry in another collection · chain E against E, TM-score 1.00
- Q9Y5K2 · AlphaFold monomer V2.0 prediction for kallikrein-4 (Q9Y5K2) · a predicted model of the same protein · chain E 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 Q9Y5K2
- Every structure of UniProt Q6VEQ7
- Elsewhere: RCSB PDB 7JQO · PDBe 7JQO · UniProt Q9Y5K2 · UniProt Q6VEQ7
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