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Crystal structure of pseudomonas aeruginosa mlic in complex with hen egg white lysozyme

Analyse Crystal structure of pseudomonas aeruginosa mlic in complex with hen egg white… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3F6Z
Type
protein
Length
444 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Lysozyme C; Putative uncharacterized protein
EC
3.2.1.17
UniProt
P00698, Q9I574
Pockets
3 · best druggability 0.66

Structure

x-ray diffraction · 2 distinct chains · 26% helix, 36% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, CLysozyme C (EC 3.2.1.17)protein12944% helix, 12% strandP00698
B, DPutative uncharacterized proteinprotein930% helix, 68% strandQ9I574

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16230.660.7547empty
2870.420.7917empty
3840.380.7716empty

Interfaces

5 interfaces between chains.

  • B–D · 1280 Ų buried · 18 hydrogen bonds · protein-protein
  • A–B · 985 Ų buried · 24 hydrogen bonds · protein-protein
  • C–D · 979 Ų buried · 25 hydrogen bonds · protein-protein
  • B–C · 123 Ų buried · 0 hydrogen bonds · protein-protein
  • A–D · 120 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 10 disulfide (disulfide).

Compared structures

  • 3F6Z · Crystal structure of Pseudomonas aeruginosa MliC in complex with hen egg white lysozyme · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9I574 · AlphaFold monomer V2.0 prediction for membrane-bound lysozyme inhibitor of C-type… · a predicted model of the same protein · chain B against A, TM-score 0.97

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