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MolNFT v1 · #34750 · protein + DNA

Crystal structure of the replication termination protein in complex with a pseudosymmetric 21MER B-site DNA

2DPU · 5'-D(P*AP*TP*GP*TP*TP*CP*AP*TP*AP*G)-3': “Crystal structure of the replication termination protein in complex with a pseudosymmetric 21MER B-site DNA”. X-ray diffraction, 1 pocket (best druggability 0.39). MolNFT v1 #34750 on…

PDB
2DPU
Type
protein + DNA
Length
136 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5'-D(P*AP*TP*GP*TP*TP*CP*AP*TP*AP*G)-3'; 5'-D(*CP*TP*AP*TP*GP*AP*AP*CP*AP*TP*T)-3'…
UniProt
P68732
Pockets
1 · best druggability 0.39

Structure

x-ray diffraction · 3 distinct chains · 53% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
D5'-D(P*AP*TP*GP*TP*TP*CP*AP*TP*AP*G)-3'dna10——
E5'-D(*CP*TP*AP*TP*GP*AP*AP*CP*AP*TP*T)-3'dna11——
AReplication termination proteinprotein11553% helix, 5% strandP68732

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1800.390.7812empty

Interfaces

3 interfaces between chains.

  • D–E · 473 Ų buried · 46 hydrogen bonds · nucleic-nucleic
  • E–A · 447 Ų buried · 9 hydrogen bonds · protein-nucleic
  • D–A · 417 Ų buried · 11 hydrogen bonds · protein-nucleic

Compared structures

  • 2DPU · Crystal structure of the replication termination protein in complex with a… · the same entry in another collection · chain D against D, TM-score 1.00

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