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Crystal structure of SPT4/5NGN heterodimer complex from methanococcus jannaschii

Analyse Crystal structure of SPT4/5NGN heterodimer complex from methanococcus jannaschii in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3LPE
Type
protein
Length
572 residues
Chains
8
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative transcription antitermination protein nusg; DNA-directed RNA polymerase subunit…
EC
2.7.7.6
UniProt
Q57818, Q57839
Ligands
ZN
Pockets
4 · best druggability 0.66

Structure

x-ray diffraction · 2 distinct chains · 24% helix, 30% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, E, GPutative transcription antitermination protein nusgprotein8436% helix, 26% strandQ57818
B, D, F, HDNA-directed RNA polymerase subunit E'' (EC 2.7.7.6)protein598% helix, 36% strandQ57839

Ligands and binding sites

  • ZN · Zinc ion · metal · 4 copies · chains B, D, F, H

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

Pockets

4 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13890.660.7933empty
23220.560.7532empty
32750.520.7532empty
4740.310.7416empty

Interfaces

9 interfaces between chains.

  • G–H · 982 Ų buried · 13 hydrogen bonds · protein-protein
  • C–D · 978 Ų buried · 11 hydrogen bonds · protein-protein
  • A–B · 974 Ų buried · 12 hydrogen bonds · protein-protein
  • E–F · 970 Ų buried · 11 hydrogen bonds · protein-protein
  • C–E · 497 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 3LPE · Crystal structure of Spt4/5NGN heterodimer complex from Methanococcus jannaschii · the same entry in another collection · chain H against H, TM-score 1.00
  • Q57839 · AlphaFold monomer V2.0 prediction for transcription elongation factor SPT4 (Q57839) · a predicted model of the same protein · chain B against A, TM-score 0.99
  • Q57818 · AlphaFold monomer V2.0 prediction for transcription elongation factor SPT5 (Q57818) · a predicted model of the same protein · chain A against A, TM-score 0.96

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