MolNFT v1 · #44715 · protein
Solution structure of calmodulin bound to the target peptide of endothelial nitrogen oxide synthase phosphorylated at THR495
2MG5: “Solution structure of calmodulin bound to the target peptide of endothelial nitrogen oxide synthase…”. Solution nmr, 1 pocket (best druggability 0.41). MolNFT v1 #44715 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 2MG5
- Type
- protein
- Length
- 164 residues
- Chains
- 2
- Method
- solution nmr
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Calmodulin; Target peptide
- UniProt
- P62158
- Pockets
- 1 · best druggability 0.41
Structure
solution nmr · 2 distinct chains · 46% helix, 0% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Calmodulin | protein | 148 | 46% helix, 0% strand | P62158 |
| B | Target peptide | protein | 16 | 44% helix, 0% strand | — |
Pockets
1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 91 | 0.41 | 0.77 | 16 | empty |
Interfaces
1 interface between chains.
- A–B · 1363 Ų buried · 9 hydrogen bonds · protein-protein
Modifications
Observed in the structure: 1 modified (phosphorylation).
Compared structures
- 2MG5 · Solution Structure of Calmodulin bound to the target peptide of Endothelial Nitrogen… · 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 P62158
- Elsewhere: RCSB PDB 2MG5 · PDBe 2MG5 · UniProt P62158
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