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Crystal structure of Fab CR6261 (somatic heavy chain with germline- reverted light chain)

Analyse Crystal structure of Fab CR6261 (somatic heavy chain with germline- reverted… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4EVN
Type
protein
Length
3,472 residues
Chains
16
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Fab heavy chain; Fab lambda light chain
Pockets
20 · best druggability 0.70

Structure

x-ray diffraction · 2 distinct chains · 7% helix, 50% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, E, G, I, K, M, OFab heavy chainprotein2217% helix, 50% strand—
B, D, F, H, J, L, N, PFab lambda light chainprotein2138% helix, 50% strand—

Pockets

20 pockets found on a 1 Å grid, 16 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18250.700.7678empty
25050.680.7959empty
34780.670.7958empty
42820.660.8241empty
55960.650.7668empty

Interfaces

39 interfaces between chains.

  • I–J · 1688 Ų buried · 14 hydrogen bonds · protein-protein
  • M–N · 1686 Ų buried · 13 hydrogen bonds · protein-protein
  • K–L · 1685 Ų buried · 13 hydrogen bonds · protein-protein
  • A–B · 1680 Ų buried · 14 hydrogen bonds · protein-protein
  • O–P · 1676 Ų buried · 15 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 32 disulfide (disulfide).

Compared structures

  • 4EVN · Crystal Structure of Fab CR6261 (somatic heavy chain with germline-reverted light chain) · the same entry in another collection · chain A against A, TM-score 1.00

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