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MolNFT v1 · #160663 · protein + DNA

Cryo-EM structure of HZTRANSIB/TIR DNA transposon end complex (tec)

6PQY · Putative DNA-mediated transposase: “Cryo-EM structure of HZTRANSIB/TIR DNA transposon end complex (tec)”. Electron microscopy, 20 pockets (best druggability 0.86). MolNFT v1 #160663 on GenesisL1: 3D structure, binding sites and…

PDB
6PQY
Type
protein + DNA
Length
984 residues
Chains
6
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative DNA-mediated transposase; DNA (5'- D(P*CP*AP*CP*GP*GP*TP*GP*GP*AP*TP*CP*GP*AP*AP*…
UniProt
B0F0C5
Pockets
20 · best druggability 0.86

Structure

electron microscopy · 3 distinct chains · 45% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, DPutative DNA-mediated transposaseprotein46045% helix, 12% strandB0F0C5
B, EDNA (5'- D(P*CP*AP*CP*GP*GP*TP*GP*GP*AP*TP*CP*GP*AP*AP*AP*A)-3')dna16——
C, FDNA (5'- D(P*TP*TP*TP*TP*CP*GP*AP*TP*CP*CP*AP*CP*CP*GP*TP*G)-3')dna16——

Pockets

20 pockets found on a 1 Å grid, 17 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16790.860.90105empty
24540.830.9181empty
31800.790.9442empty
41740.780.9342empty
5800.690.9420empty

Interfaces

11 interfaces between chains.

  • A–D · 1042 Ų buried · 4 hydrogen bonds · protein-protein
  • B–C · 691 Ų buried · 65 hydrogen bonds · nucleic-nucleic
  • E–F · 690 Ų buried · 61 hydrogen bonds · nucleic-nucleic
  • A–F · 556 Ų buried · 6 hydrogen bonds · protein-nucleic
  • C–D · 546 Ų buried · 6 hydrogen bonds · protein-nucleic

Compared structures

  • 6PQY · Cryo-EM structure of HzTransib/TIR DNA transposon end complex (TEC) · the same entry in another collection · chain A against A, TM-score 1.00

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