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Crystal structure of a cross-reaction complex between Fab F9.13.7 and guinea-fowl lysozyme

Analyse Crystal structure of a cross-reaction complex between Fab F9.13.7 and… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1FBI
Type
protein
Length
1,128 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
IGG1 F9.13.7 Fab (light chain); IGG1 F9.13.7 Fab (heavy chain); Guinea fowl lysozyme
EC
3.2.1.17
UniProt
P01868, P00704
Pockets
11 · best druggability 0.55

Structure

x-ray diffraction · 3 distinct chains · 12% helix, 37% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
L, PIGG1 F9.13.7 Fab (light chain)protein2144% helix, 43% strand—
H, QIGG1 F9.13.7 Fab (heavy chain)protein2215% helix, 48% strandP01868
X, YGuinea fowl lysozyme (EC 3.2.1.17)protein12937% helix, 10% strandP00704

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13210.550.7540empty
21100.490.8023empty
3610.390.8017empty
4900.370.7516empty
51340.350.7226empty

Interfaces

6 interfaces between chains.

  • L–H · 1928 Ų buried · 19 hydrogen bonds · protein-protein
  • P–Q · 1909 Ų buried · 11 hydrogen bonds · protein-protein
  • Q–Y · 710 Ų buried · 17 hydrogen bonds · protein-protein
  • H–X · 706 Ų buried · 13 hydrogen bonds · protein-protein
  • P–Y · 273 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 16 disulfide (disulfide).

Compared structures

  • 1FBI · Crystal structure of a cross-reaction complex between Fab F9.13.7 and guinea-fowl lysozyme · the same entry in another collection · chain Y against Y, TM-score 1.00
  • P00704 · AlphaFold monomer V2.0 prediction for lysozyme C (P00704) · a predicted model of the same protein · chain X against A, TM-score 0.98
  • P01868 · AlphaFold monomer V2.0 prediction for ig gamma-1 chain C region secreted form (P01868) · a predicted model of the same protein · chain H against A, TM-score 0.48

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