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Crystal structure of domain III from the thermotoga maritima replication initiation protein dnaa

Analyse Crystal structure of domain III from the thermotoga maritima replication… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2Z4S
Type
protein
Length
240 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Chromosomal replication initiator protein dnaa
UniProt
P46798
Ligands
ADP, MG
Pockets
1 · best druggability 0.69

Structure

x-ray diffraction · 1 distinct chain · 55% helix, 9% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AChromosomal replication initiator protein dnaaprotein24055% helix, 9% strandP46798

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · chains A
  • MG · Magnesium ion · metal · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12330.690.8525MG, ADP

Compared structures

  • 2Z4S · Crystal structure of domain III from the Thermotoga maritima replication initiation… · the same entry in another collection · chain A against A, TM-score 1.00
  • P46798 · AlphaFold monomer V2.0 prediction for chromosomal replication initiator protein dnaa… · a predicted model of the same protein · chain A against A, TM-score 0.99

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