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MolNFT v1 · #118613 · protein

Crystal structure of germ-line precursor of 3BNC60 Fab

5F7E · Fab heavy chain: “Crystal structure of germ-line precursor of 3BNC60 Fab”. X-ray diffraction, 3 pockets (best druggability 0.58). MolNFT v1 #118613 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5F7E
Type
protein
Length
428 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Fab heavy chain; Fab light chain
Pockets
3 · best druggability 0.58

Structure

x-ray diffraction · 2 distinct chains · 9% helix, 51% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
HFab heavy chainprotein22112% helix, 51% strand—
LFab light chainprotein2076% helix, 52% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14560.580.7455empty
2560.440.8422empty
31130.400.7621empty

Interfaces

1 interface between chains.

  • H–L · 1839 Ų buried · 22 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 5F7E · Crystal structure of germ-line precursor of 3BNC60 Fab · the same entry in another collection · chain H against H, TM-score 1.00

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