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MolNFT v1 · #21107 · protein + DNA

Crystal structure of DNA polymerase lambda complexed with a two nucleotide gap DNA molecule

1RZT · 5'-D(*CP*GP*GP*CP*AP*AP*CP*GP*CP*AP*C)-3': “Crystal structure of DNA polymerase lambda complexed with a two nucleotide gap DNA molecule”. X-ray diffraction, 1 ligand (NA), 10 pockets (best druggability 0.77). MolNFT v1 #21107 on…

PDB
1RZT
Type
protein + DNA
Length
1,386 residues
Chains
16
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5'-D(*CP*GP*GP*CP*AP*AP*CP*GP*CP*AP*C)-3'; 5'-D(*GP*TP*GP*CP*G)-3'…
EC
2.7.7.7
UniProt
Q9UGP5
Ligands
NA
Pockets
10 · best druggability 0.77

Structure

x-ray diffraction · 5 distinct chains · 48% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
B, F, J, N5'-D(*CP*GP*GP*CP*AP*AP*CP*GP*CP*AP*C)-3'dna11——
C, G, K, O5'-D(*GP*TP*GP*CP*G)-3'dna5——
D, H, L, P5'-D(P*GP*CP*CP*G)-3'dna4——
A, MDNA polymerase lambda (EC 2.7.7.7)protein32748% helix, 16% strandQ9UGP5
E, IDNA polymerase lambda (EC 2.7.7.7)protein32648% helix, 15% strandQ9UGP5

Ligands and binding sites

  • NA · Sodium ion · metal · 10 copies · chains B, D, F, H, J, L, C, A, G, E, K, I, O, M, P
  • EDO · 1,2-ethanediol · additive · chains M

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

Pockets

10 pockets found on a 1 Å grid, 9 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110920.770.80104empty
28500.740.7971empty
38220.740.7969empty
48330.740.7977empty
511780.720.7675empty

Interfaces

33 interfaces between chains.

  • F–E · 600 Ų buried · 8 hydrogen bonds · protein-nucleic
  • J–I · 596 Ų buried · 13 hydrogen bonds · protein-nucleic
  • N–M · 583 Ų buried · 10 hydrogen bonds · protein-nucleic
  • B–A · 576 Ų buried · 8 hydrogen bonds · protein-nucleic
  • A–M · 524 Ų buried · 5 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 1RZT · Crystal structure of DNA polymerase lambda complexed with a two nucleotide gap DNA… · the same entry in another collection · chain M against M, TM-score 1.00

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