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MolNFT v1 · #102861 · protein

Crystal structure of mltf from pseudomonas aeruginosa complexed with leucine

4OYV · Membrane-bound lytic murein transglycosylase F: “Crystal structure of mltf from pseudomonas aeruginosa complexed with leucine”. X-ray diffraction, 2 ligands (LEU, CL), 7 pockets (best druggability 0.63). MolNFT v1 #102861 on…

PDB
4OYV
Type
protein
Length
424 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Membrane-bound lytic murein transglycosylase F
EC
4.2.2.-
UniProt
Q9HXN1
Ligands
LEU, CL
Pockets
7 · best druggability 0.63

Structure

x-ray diffraction · 1 distinct chain · 50% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMembrane-bound lytic murein transglycosylase F (EC 4.2.2.-)protein42450% helix, 14% strandQ9HXN1

Ligands and binding sites

  • LEU · Leucine · ligand · chains A
  • CL · Chloride ion · ion · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12190.630.8240LEU
23170.570.7638CL
31400.430.7522empty
4720.390.7921empty
5540.350.7818empty

Compared structures

  • 4OYV · Crystal structure of MltF from Pseudomonas aeruginosa complexed with leucine · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9HXN1 · AlphaFold monomer V2.0 prediction for membrane-bound lytic murein transglycosylase F… · a predicted model of the same protein · chain A against A, TM-score 0.99

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