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Crystal structure of MOR04357, a neutralizing anti-human gm-csf antibody Fab fragment

Analyse Crystal structure of MOR04357, a neutralizing anti-human gm-csf antibody Fab… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5D7S
Type
protein
Length
423 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Immunglobulin G1 Fab fragment, light chain; Immunglobulin G1 Fab fragment, heavy chain
Ligands
BUD
Pockets
4 · best druggability 0.58

Structure

x-ray diffraction · 2 distinct chains · 8% helix, 50% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
LImmunglobulin G1 Fab fragment, light chainprotein2058% helix, 49% strand—
HImmunglobulin G1 Fab fragment, heavy chainprotein2188% helix, 50% strand—

Ligands and binding sites

  • BUD · (2S,3S)-butane-2,3-diol · ligand · 2 copies · chains L, 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
14010.580.7545empty
22180.480.7428empty
3750.430.8017BUD
4670.380.7815empty

Interfaces

1 interface between chains.

  • L–H · 1651 Ų buried · 12 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 5D7S · Crystal structure of MOR04357, a neutralizing anti-human GM-CSF antibody Fab fragment · the same entry in another collection · chain L against L, TM-score 1.00

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