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Crystal structure of HSALC1

Analyse Crystal structure of HSALC1 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7EPU
Type
protein
Length
978 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Non-immunized human scfv; Chromodomain-helicase-DNA-binding protein 1-like
EC
3.6.4.12
UniProt
Q86WJ1
Ligands
ADP, MG
Pockets
19 · best druggability 0.73

Structure

x-ray diffraction · 2 distinct chains · 33% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ANon-immunized human scfvprotein2305% helix, 50% strand—
BChromodomain-helicase-DNA-binding protein 1-like (EC 3.6.4.12)protein74841% helix, 11% strandQ86WJ1

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · chains B
  • MG · Magnesium ion · metal · chains B

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

Pockets

19 pockets found on a 1 Å grid, 8 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1660.730.9718empty
26100.730.8084ADP, MG
3640.680.9524empty
43880.640.7836empty
52770.620.8039empty

Interfaces

1 interface between chains.

  • A–B · 1349 Ų buried · 18 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 covalent, 2 disulfide (covalent ligand, disulfide).

Compared structures

  • 7EPU · Crystal structure of HsALC1 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q86WJ1 · AlphaFold monomer V2.0 prediction for chromodomain-helicase-DNA- binding protein 1-like… · a predicted model of the same protein · chain B against A, TM-score 0.53

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