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MolNFT v1 · #52342 · protein

Crystal structure of murine reference antibody 125-2H Fab fragment

2VXU · Murine IgG 125-2H: “Crystal structure of murine reference antibody 125-2H Fab fragment”. X-ray diffraction, 9 pockets (best druggability 0.68). MolNFT v1 #52342 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2VXU
Type
protein
Length
860 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Murine IgG 125-2H
Pockets
9 · best druggability 0.68

Structure

x-ray diffraction · 2 distinct chains · 6% helix, 51% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
H, IMurine IgG 125-2Hprotein2166% helix, 51% strand—
L, MMurine IgG 125-2Hprotein2146% helix, 51% strand—

Pockets

9 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17110.680.7687empty
21700.530.7928empty
32300.460.7325empty
42130.460.7338empty
51660.420.7430empty

Interfaces

6 interfaces between chains.

  • H–L · 1816 Ų buried · 17 hydrogen bonds · protein-protein
  • I–M · 1751 Ų buried · 17 hydrogen bonds · protein-protein
  • I–L · 232 Ų buried · 2 hydrogen bonds · protein-protein
  • H–I · 114 Ų buried · 1 hydrogen bond · protein-protein
  • L–M · 64 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 10 disulfide (disulfide).

Compared structures

  • 2VXU · Crystal structure of murine reference antibody 125-2H Fab fragment · the same entry in another collection · chain H against H, TM-score 1.00

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