GL1X · GenesisL1 explorer

MolNFT v1 · #168082 · protein

Structure of anti-ferroportin FAB45D8

6W4V · FAB45D8 light chain: “Structure of anti-ferroportin FAB45D8”. X-ray diffraction, 6 pockets (best druggability 0.45). MolNFT v1 #168082 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6W4V
Type
protein
Length
438 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
FAB45D8 light chain; FAB45D8 heavy chain
Pockets
6 · best druggability 0.45

Structure

x-ray diffraction · 2 distinct chains · 5% helix, 52% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
DFAB45D8 light chainprotein2186% helix, 52% strand—
CFAB45D8 heavy chainprotein2204% helix, 52% strand—

Ligands and binding sites

  • EDO · 1,2-ethanediol · additive · 5 copies · chains D, C

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

Pockets

6 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12040.450.7426empty
21330.430.7624empty
3830.410.7817empty
4810.310.7318empty
5500.310.7713empty

Interfaces

1 interface between chains.

  • D–C · 2047 Ų buried · 14 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 5 disulfide (disulfide).

Compared structures

  • 6W4V · Structure of anti-ferroportin Fab45D8 · the same entry in another collection · chain D against D, TM-score 1.00

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