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MolNFT v1 · #146256 · protein

Rsv-neutralizing human antibody AM22

6DC4 · Fab AM22 heavy chain: “Rsv-neutralizing human antibody AM22”. X-ray diffraction, 4 pockets (best druggability 0.60). MolNFT v1 #146256 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6DC4
Type
protein
Length
437 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Fab AM22 heavy chain; Fab AM22 light chain
UniProt
Q6GMX6, Q8TCD0
Pockets
4 · best druggability 0.60

Structure

x-ray diffraction · 2 distinct chains · 7% helix, 53% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
HFab AM22 heavy chainprotein2227% helix, 52% strandQ6GMX6
LFab AM22 light chainprotein2157% helix, 53% strandQ8TCD0

Ligands and binding sites

  • EDO · 1,2-ethanediol · additive · 17 copies · chains H, L

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14750.600.7549EDO
22000.460.7432EDO
3680.450.8223EDO
4940.350.7417empty

Interfaces

1 interface between chains.

  • H–L · 1859 Ų buried · 12 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 5 disulfide (disulfide).

Compared structures

  • 6DC4 · RSV-neutralizing human antibody AM22 · the same entry in another collection · chain H against H, TM-score 1.00

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