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MolNFT v1 · #42574 · protein

NMR solution structures of fully oxidised cytochrome C3 from desulfovibrio desulfuricans atcc 27774

2KMY: “NMR solution structures of fully oxidised cytochrome C3 from desulfovibrio desulfuricans atcc 27774”. Solution nmr, 1 ligand (HEC), 1 pocket (best druggability 0.75). MolNFT v1 #42574 on GenesisL1: 3D structure, binding sites and…

PDB
2KMY
Type
protein
Length
107 residues
Chains
1
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cytochrome C3
UniProt
Q9L915
Ligands
HEC
Pockets
1 · best druggability 0.75

Structure

solution nmr · 1 distinct chain · 15% helix, 7% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACytochrome C3protein10715% helix, 7% strandQ9L915

Ligands and binding sites

  • HEC · Heme C · ligand · 4 copies · chains A

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

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18450.750.7971HEC

Modifications

Observed in the structure: 8 cofactor (heme c attachment).

Compared structures

  • 2KMY · NMR Solution structures of fully oxidised cytochrome c3 from Desulfovibrio desulfuricans… · the same entry in another collection · chain A against A, TM-score 1.00

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