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MolNFT v1 · #175899 · protein

Crystal structure of LYS170 cbd

7D55 · Putative N-acetylmuramoyl-L-alanine amidase: “Crystal structure of LYS170 cbd”. X-ray diffraction, 1 pocket (best druggability 0.70). MolNFT v1 #175899 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7D55
Type
protein
Length
348 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative N-acetylmuramoyl-L-alanine amidase
UniProt
A0A2Z6FZW5
Pockets
1 · best druggability 0.70

Structure

x-ray diffraction · 1 distinct chain · 26% helix, 30% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DPutative N-acetylmuramoyl-L-alanine amidaseprotein8726% helix, 30% strandA0A2Z6FZW5

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12540.700.8535empty

Interfaces

4 interfaces between chains.

  • B–C · 897 Ų buried · 10 hydrogen bonds · protein-protein
  • B–D · 870 Ų buried · 10 hydrogen bonds · protein-protein
  • A–C · 862 Ų buried · 10 hydrogen bonds · protein-protein
  • A–D · 862 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 7D55 · Crystal structure of lys170 CBD · the same entry in another collection · chain A against A, TM-score 1.00

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