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The unliganded germline precursor to the sulfide oxidase catalytic antibody 28B4.

Analyse The unliganded germline precursor to the sulfide oxidase catalytic antibody… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1FL5
Type
protein
Length
872 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Antibody germline precursor to antibody 28B4
Ligands
SO4
Pockets
15 · best druggability 0.70

Structure

x-ray diffraction · 2 distinct chains · 6% helix, 50% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
L, AAntibody germline precursor to antibody 28B4protein2176% helix, 53% strand—
H, BAntibody germline precursor to antibody 28B4protein2197% helix, 48% strand—

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 2 copies · chains L, H, A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16110.700.7964empty
22420.570.7931empty
33310.550.7541empty
4950.530.8419empty
5970.530.8320empty

Interfaces

5 interfaces between chains.

  • L–H · 1948 Ų buried · 14 hydrogen bonds · protein-protein
  • A–B · 1945 Ų buried · 16 hydrogen bonds · protein-protein
  • H–B · 781 Ų buried · 6 hydrogen bonds · protein-protein
  • H–A · 121 Ų buried · 1 hydrogen bond · protein-protein
  • L–B · 75 Ų buried · 1 hydrogen bond · protein-protein

Modifications

Observed in the structure: 8 disulfide (disulfide).

Compared structures

  • 1FL5 · The unliganded germline precursor to the sulfide oxidase catalytic antibody 28B4. · the same entry in another collection · chain L against L, TM-score 1.00

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