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SCO3201 with putative ligand

Analyse SCO3201 with putative ligand in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7PT0
Type
protein
Length
399 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Tetr family transcriptional regulator
UniProt
A0A6M9XK53
Ligands
SPD
Pockets
1 · best druggability 0.87

Structure

x-ray diffraction · 2 distinct chains · 76% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATetr family transcriptional regulatorprotein20177% helix, 0% strandA0A6M9XK53
BTetr family transcriptional regulatorprotein19875% helix, 0% strandA0A6M9XK53

Ligands and binding sites

  • SPD · Spermidine · ligand · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111200.870.87115SPD

Interfaces

1 interface between chains.

  • A–B · 974 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 7PT0 · SCO3201 with putative ligand · the same entry in another collection · chain A against A, TM-score 1.00

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