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MolNFT v1 · #47998 · protein + DNA

DNA polymerase lambda in complex with DNA and dctp

2PFP · Template: “DNA polymerase lambda in complex with DNA and dctp”. X-ray diffraction, 3 ligands (DCP, NA, MG), 4 pockets (best druggability 0.67). MolNFT v1 #47998 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2PFP
Type
protein + DNA
Length
347 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Template; Primer; Downstream primer; DNA polymerase lambda
EC
2.7.7.7, 4.2.99.-
UniProt
Q9UGP5
Ligands
DCP, NA, MG
Pockets
4 · best druggability 0.67

Structure

x-ray diffraction · 4 distinct chains · 48% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
TTemplatedna11——
PPrimerdna6——
DDownstream primerdna4——
ADNA polymerase lambda (EC 2.7.7.7, 4.2.99.-)protein32648% helix, 14% strandQ9UGP5

Ligands and binding sites

  • DCP · 2'-deoxycytidine-5'-triphosphate · ligand · chains T, P, A
  • NA · Sodium ion · metal · 5 copies · chains D, A, P, T
  • MG · Magnesium ion · metal · chains A

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
17980.670.7555MG, DCP
21000.570.8528empty
31300.530.8221empty
42690.480.7432empty

Interfaces

5 interfaces between chains.

  • T–A · 963 Ų buried · 20 hydrogen bonds · protein-nucleic
  • D–A · 390 Ų buried · 13 hydrogen bonds · protein-nucleic
  • P–A · 384 Ų buried · 14 hydrogen bonds · protein-nucleic
  • T–P · 285 Ų buried · 22 hydrogen bonds · nucleic-nucleic
  • T–D · 190 Ų buried · 19 hydrogen bonds · nucleic-nucleic

Compared structures

  • 2PFP · DNA Polymerase lambda in complex with DNA and dCTP · the same entry in another collection · chain T against T, TM-score 1.00
  • Q9UGP5 · AlphaFold monomer V2.0 prediction for DNA polymerase lambda (Q9UGP5) · a predicted model of the same protein · chain A against A, TM-score 0.99

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