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Structure of GM9_TH8SEQ732127 Fab

Analyse Structure of GM9_TH8SEQ732127 Fab in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6U9U
Type
protein
Length
430 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
GM9_TH8SEQ732127 Fab heavy chain; GM9_TH8SEQ732127 Fab light chain
Ligands
NA
Pockets
3 · best druggability 0.59

Structure

x-ray diffraction · 2 distinct chains · 6% helix, 54% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
HGM9_TH8SEQ732127 Fab heavy chainprotein2186% helix, 55% strand—
LGM9_TH8SEQ732127 Fab light chainprotein2126% helix, 52% strand—

Ligands and binding sites

  • NA · Sodium ion · metal · 6 copies · chains H, L
  • FMT · Formic acid · additive · 2 copies · chains H, L
  • EDO · 1,2-ethanediol · additive · 2 copies · chains H, L

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15250.590.7356FMT
2940.330.7325NA
3520.260.7417EDO

Interfaces

1 interface between chains.

  • H–L · 1768 Ų buried · 14 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 6U9U · Structure of GM9_TH8seq732127 FAB · the same entry in another collection · chain H against H, TM-score 1.00

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