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Crystal structure of C-terminal domain of MSK1 in complex with covalently bound pyrrolopyrimidine compound 23 (co-crystal)
Analyse Crystal structure of C-terminal domain of MSK1 in complex with covalently bound… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.
- PDB
- 7UP5
- Type
- protein
- Length
- 561 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- O75582
- Ligands
- O1R, IOD
Structure
x-ray diffraction · 2 distinct chains.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 275 | — | O75582 |
| B | — | protein | 286 | — | O75582 |
Ligands and binding sites
- O1R · (2M)-6-chloro-2-(5H-pyrrolo[3,2-d]pyrimidin-5-yl) pyridine-3-carbonitrile · ligand · 2 copies · chains A, B
- IOD · Iodide ion · ion · 3 copies · chains A, B
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 7UP5 · Crystal structure of C-terminal Domain of MSK1 in complex with covalently bound… · the same entry in another collection · chain A against A, TM-score 1.00
- O75582 · AlphaFold monomer V2.0 prediction for ribosomal protein S6 kinase alpha-5 (O75582) · a predicted model of the same protein · chain A against A, TM-score 0.95
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 O75582
- Elsewhere: RCSB PDB 7UP5 · PDBe 7UP5 · UniProt O75582
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