MolNFT v2 · #186035 · protein
Structure of Human MPS1 (TTK) covalently bound to RMS-07 inhibitor
7LQD: “Structure of Human MPS1 (TTK) covalently bound to RMS-07 inhibitor”. X-ray diffraction at 1.95, 2 ligands (YB4, TOE). MolNFT v2 #186035 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 7LQD
- Type
- protein
- Length
- 269 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v2 / PDB Bank
- Contract
- 0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
- Owner
- 0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
- Resolution
- 1.95
- Source
- Homo sapiens
- Ligands
- YB4, TOE
Structure
x-ray diffraction · resolution 1.95 · 1 distinct chain.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 269 | — | — |
Ligands and binding sites
- YB4 · ~{N}-(2,6-diethylphenyl)-2-[[4-(4-methylpiperazin-1-yl)-2-(propanoylamino)phenyl]amino]-5,6-dihydropyrimido[4,5-e]indolizine-7-carboxamide · ligand · chains A
- TOE · 2-[2-(2-methoxy-ethoxy)-ethoxy]-ethoxyl · ligand · chains A
- GOL · Glycerol · additive · 5 copies · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 7LQD · Structure of human MPS1 (ttk) covalently bound to rms-07 inhibitor · 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
- Elsewhere: RCSB PDB 7LQD · PDBe 7LQD
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