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Crystal structure of ZMMOC1 H253A mutant in complex with holliday junction

Analyse Crystal structure of ZMMOC1 H253A mutant in complex with holliday junction in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6JRG
Type
protein + DNA
Length
391 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Monokaryotic chloroplast 1; DNA (33-mer); DNA (32-mer)
UniProt
B4FCI7
Ligands
MG
Pockets
6 · best druggability 0.69

Structure

x-ray diffraction · 3 distinct chains · 44% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BMonokaryotic chloroplast 1protein16344% helix, 23% strandB4FCI7
CDNA (33-mer)dna33——
DDNA (32-mer)dna32——

Ligands and binding sites

  • MG · Magnesium ion · metal · 2 copies · chains A, D, B, C

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17160.690.7736empty
27500.690.7642empty
31910.560.7930empty
41920.550.7928empty
5840.370.7713empty

Interfaces

6 interfaces between chains.

  • A–D · 1126 Ų buried · 18 hydrogen bonds · protein-nucleic
  • B–C · 1099 Ų buried · 20 hydrogen bonds · protein-nucleic
  • A–B · 944 Ų buried · 8 hydrogen bonds · protein-protein
  • C–D · 831 Ų buried · 87 hydrogen bonds · nucleic-nucleic
  • B–D · 602 Ų buried · 19 hydrogen bonds · protein-nucleic

Compared structures

  • 6JRG · Crystal structure of ZmMoc1 H253A mutant in complex with Holliday junction · the same entry in another collection · chain A against A, TM-score 1.00

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