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MolNFT v1 · #159921 · protein + DNA

Drosophila P element transposase strand transfer complex

6P5A · Transposable element P transposase: “Drosophila P element transposase strand transfer complex”. Electron microscopy, 2 ligands (GTP, MG), 20 pockets (best druggability 0.84). MolNFT v1 #159921 on GenesisL1: 3D structure, binding…

PDB
6P5A
Type
protein + DNA
Length
1,256 residues
Chains
10
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Transposable element P transposase; DNA (5'-D(P*CP*GP*AP*AP*CP*TP*AP*TP*A)-3'); DNA…
EC
2.7.7.-
UniProt
Q7M3K2
Ligands
GTP, MG
Pockets
20 · best druggability 0.84

Structure

electron microscopy · 5 distinct chains · 50% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, GTransposable element P transposase (EC 2.7.7.-)protein44248% helix, 13% strandQ7M3K2
B, HTransposable element P transposase (EC 2.7.7.-)protein11858% helix, 3% strandQ7M3K2
C, IDNA (5'-D(P*CP*GP*AP*AP*CP*TP*AP*TP*A)-3')dna9——
D, JDNA (5'-D(P*AP*GP*GP*TP*GP*GP*TP*CP*CP*CP*GP*TP*CP*GP*G)- 3')dna15——
E, KDNA (44-mer)dna44——

Ligands and binding sites

  • GTP · Guanosine-5'-triphosphate · ligand · 2 copies · chains A, K, E, G
  • MG · Magnesium ion · metal · 4 copies · chains A, C, K, E, G, I

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

Pockets

20 pockets found on a 1 Å grid, 11 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19990.840.8577empty
26700.840.8872empty
311360.820.8498empty
43420.770.8844GTP, MG
54470.760.8546GTP, MG

Interfaces

26 interfaces between chains.

  • A–K · 1532 Ų buried · 31 hydrogen bonds · protein-nucleic
  • E–G · 1527 Ų buried · 30 hydrogen bonds · protein-nucleic
  • A–G · 1426 Ų buried · 6 hydrogen bonds · protein-protein
  • A–H · 1157 Ų buried · 16 hydrogen bonds · protein-protein
  • B–G · 1153 Ų buried · 16 hydrogen bonds · protein-protein

Compared structures

  • 6P5A · Drosophila P element transposase strand transfer complex · the same entry in another collection · chain K against K, TM-score 1.00
  • Q7M3K2 · AlphaFold monomer V2.0 prediction for transposable element P transposase (Q7M3K2) · a predicted model of the same protein · chain B against A, TM-score 0.99

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