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Crystal structure of the ecoli clamp loader bound to primer-template DNA

Analyse Crystal structure of the ecoli clamp loader bound to primer-template DNA in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3GLF
Type
protein + DNA
Length
3,578 residues
Chains
14
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA polymerase III subunit delta; DNA polymerase III subunit tau; DNA polymerase III…
EC
2.7.7.7
UniProt
P28630, P06710, P28631
Ligands
ADP, BEF, ZN, MG
Pockets
20 · best druggability 0.83

Structure

x-ray diffraction · 8 distinct chains · 55% helix, 9% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, FDNA polymerase III subunit delta (EC 2.7.7.7)protein33351% helix, 11% strandP28630
BDNA polymerase III subunit tau (EC 2.7.7.7)protein36456% helix, 8% strandP06710
C, HDNA polymerase III subunit tau (EC 2.7.7.7)protein36555% helix, 8% strandP06710
D, IDNA polymerase III subunit tau (EC 2.7.7.7)protein36257% helix, 8% strandP06710
E, JDNA polymerase III subunit delta' (EC 2.7.7.7)protein33454% helix, 9% strandP28631
GDNA polymerase III subunit tau (EC 2.7.7.7)protein37854% helix, 7% strandP06710
K, MDNA (5'-D(*TP*TP*TP*TP*TP*TP*AP*TP*AP*GP*GP*CP*CP*AP*G)- 3')dna14——
L, NDNA (5'-D(*CP*TP*GP*GP*CP*CP*TP*AP*TP*A)-3')dna10——

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · 6 copies · chains B, C, D, E, G, H, I, J
  • BEF · Beryllium trifluoride ion · ligand · 6 copies · chains B, C, D, E, G, H, I, J
  • ZN · Zinc ion · metal · 8 copies · chains B, C, D, E, G, H, I, J
  • MG · Magnesium ion · metal · 6 copies · chains B, C, D, E, G, H, I, J

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18350.830.8583empty
211210.820.83104empty
38250.800.8362empty
49240.790.82112empty
57030.790.8379empty

Interfaces

39 interfaces between chains.

  • G–H · 2974 Ų buried · 34 hydrogen bonds · protein-protein
  • B–C · 2738 Ų buried · 30 hydrogen bonds · protein-protein
  • H–I · 2516 Ų buried · 28 hydrogen bonds · protein-protein
  • C–D · 2430 Ų buried · 30 hydrogen bonds · protein-protein
  • I–J · 2394 Ų buried · 27 hydrogen bonds · protein-protein

Compared structures

  • 3GLF · Crystal Structure of the Ecoli Clamp Loader Bound to Primer-Template DNA · the same entry in another collection · chain N against N, TM-score 1.00

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