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MolNFT v1 · #22203 · protein

Transfer of a beta-turn structure to a new protein context

1SYB · Staphylococcal nuclease: “Transfer of a beta-turn structure to a new protein context”. X-ray diffraction, 2 ligands (THP, CA), 1 pocket (best druggability 0.45). MolNFT v1 #22203 on GenesisL1: 3D structure, binding sites and pockets…

PDB
1SYB
Type
protein
Length
137 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Staphylococcal nuclease
EC
3.1.31.1
UniProt
P00644
Ligands
THP, CA
Pockets
1 · best druggability 0.45

Structure

x-ray diffraction · 1 distinct chain · 26% helix, 30% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AStaphylococcal nuclease (EC 3.1.31.1)protein13726% helix, 30% strandP00644

Ligands and binding sites

  • THP · Thymidine-3',5'-diphosphate · ligand · chains A
  • CA · Calcium ion · metal · 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11340.450.7728CA, THP

Compared structures

  • 1SYB · Transfer of a beta-turn structure to a new protein context · the same entry in another collection · chain A against A, TM-score 1.00

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