MolNFT v1 · #15122 · protein

Solution NMR structure of CALMODULIN/W-7 complex: the basis of diversity in molecular recognition, 30 structures

1MUX: “Solution NMR structure of CALMODULIN/W-7 complex: the basis of diversity in molecular recognition, 30…”. Solution nmr, 2 ligands (WW7, CA), 2 pockets (best druggability 0.44). MolNFT v1 #15122 on GenesisL1: 3D structure, binding…

PDB: 1MUX
Type: protein
Length: 148 residues
Chains: 1
Method: solution nmr
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Calmodulin
UniProt: P62155
Ligands: WW7, CA
Pockets: 2 · best druggability 0.44

Structure

solution nmr · 1 distinct chain · 54% helix, 3% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	Calmodulin	protein	148	54% helix, 3% strand	P62155

Ligands and binding sites

WW7 · N-(6-aminohexyl)-5-chloro-1-naphthalenesulfonamide · ligand · 2 copies · chains A
CA · Calcium ion · metal · 4 copies · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

2 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	76	0.44	0.79	14	WW7
2	64	0.36	0.77	13	WW7

Compared structures

1MUX · Solution NMR structure of CALMODULIN/W-7 complex: the basis of diversity in molecular… · 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 P62155
Elsewhere: RCSB PDB 1MUX · PDBe 1MUX · UniProt P62155

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