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Fab fragment of calcium-dependent antigen binding antibody, 6RL#9

Analyse Fab fragment of calcium-dependent antigen binding antibody, 6RL#9 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5AZE
Type
protein
Length
430 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
6RL#9 Fab light chain; 6RL#9 Fab heavy chain
Ligands
CA
Pockets
4 · best druggability 0.55

Structure

x-ray diffraction · 2 distinct chains · 7% helix, 52% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
L6RL#9 Fab light chainprotein2067% helix, 51% strand—
H6RL#9 Fab heavy chainprotein2248% helix, 52% strand—

Ligands and binding sites

  • CA · Calcium ion · metal · chains H

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13840.550.7462empty
21420.430.7523empty
31340.410.7521empty
4500.280.7518empty

Interfaces

1 interface between chains.

  • L–H · 1799 Ų buried · 14 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 5 disulfide, 1 modified (disulfide, cyclization).

Compared structures

  • 5AZE · Fab fragment of calcium-dependent antigen binding antibody, 6RL#9 · the same entry in another collection · chain L against L, TM-score 1.00

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