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Structural basis for the recognition of attp substrates by P4-like integrases

Analyse Structural basis for the recognition of attp substrates by P4-like integrases in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3RMP
Type
protein + DNA
Length
207 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
CP4-like integrase; 5'-D(*TP*AP*AP*TP*GP*AP*CP*CP*AP*CP*CP*AP*AP*TP*A)-3'…
UniProt
Q9Z3B4
Pockets
5 · best druggability 0.53

Structure

x-ray diffraction · 5 distinct chains · 26% helix, 36% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACP4-like integraseprotein7726% helix, 35% strandQ9Z3B4
CCP4-like integraseprotein7527% helix, 36% strandQ9Z3B4
E5'-D(*TP*AP*AP*TP*GP*AP*CP*CP*AP*CP*CP*AP*AP*TP*A)-3'dna14——
F, H5'-D(*TP*AP*TP*TP*GP*GP*TP*GP*GP*TP*CP*AP*TP*TP*A)-3'dna13——
G5'-D(*TP*AP*AP*TP*GP*AP*CP*CP*AP*CP*CP*AP*AP*TP*A)-3'dna15——

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11310.530.8129empty
2650.420.8111empty
31040.420.7816empty
4710.410.8012empty
5520.260.7412empty

Interfaces

9 interfaces between chains.

  • A–C · 640 Ų buried · 4 hydrogen bonds · protein-protein
  • G–H · 603 Ų buried · 51 hydrogen bonds · nucleic-nucleic
  • E–F · 578 Ų buried · 54 hydrogen bonds · nucleic-nucleic
  • A–G · 566 Ų buried · 12 hydrogen bonds · protein-nucleic
  • C–E · 527 Ų buried · 13 hydrogen bonds · protein-nucleic

Compared structures

  • 3RMP · Structural basis for the recognition of attP substrates by P4-like integrases · the same entry in another collection · chain A against A, TM-score 1.00

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