GL1X · GenesisL1 explorer

MolNFT v1 · #32090 · protein

Monoclonal antibody fragment FV4155 from E. COLI

2BFV: “Monoclonal antibody fragment FV4155 from E. COLI”. X-ray diffraction, 1 ligand (STG), 3 pockets (best druggability 0.50). MolNFT v1 #32090 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2BFV
Type
protein
Length
231 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
FV4155
UniProt
P01631
Ligands
STG
Pockets
3 · best druggability 0.50

Structure

x-ray diffraction · 2 distinct chains · 4% helix, 52% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
LFV4155protein1123% helix, 47% strandP01631
HFV4155protein1195% helix, 55% strand—

Ligands and binding sites

  • STG · Estriol 3-(B-D-glucuronide) · ligand · chains L, H

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
11510.500.7822STG
21210.440.7725empty
3900.330.7318empty

Interfaces

1 interface between chains.

  • L–H · 849 Ų buried · 8 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 2BFV · Monoclonal antibody fragment FV4155 from E. COLI · the same entry in another collection · chain L against L, TM-score 1.00
  • P01631 · AlphaFold monomer V2.0 prediction for ig kappa chain V-II region 26-10 (P01631) · a predicted model of the same protein · chain L against A, TM-score 0.96

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