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A 2.2A crystal structure of the AP2 domain of PF14_0633 from P. falciparum, bound as a domain-swapped dimer to its cognate DNA

Analyse A 2.2A crystal structure of the AP2 domain of PF14_0633 from P. falciparum… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3IGM
Type
protein + DNA
Length
149 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
PF14_0633 protein; 5'-D(*TP*GP*CP*AP*TP*GP*CP*A)-3'
UniProt
Q8IKH2
Pockets
2 · best druggability 0.33

Structure

x-ray diffraction · 4 distinct chains · 31% helix, 32% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
BPF14_0633 proteinprotein6229% helix, 31% strandQ8IKH2
W, X, C5'-D(*TP*GP*CP*AP*TP*GP*CP*A)-3'dna8——
APF14_0633 proteinprotein5634% helix, 34% strandQ8IKH2
D5'-D(*TP*GP*CP*AP*TP*GP*CP*A)-3'dna7——

Pockets

2 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1580.330.7716empty
2850.310.7321empty

Interfaces

7 interfaces between chains.

  • B–A · 1592 Ų buried · 14 hydrogen bonds · protein-protein
  • B–X · 469 Ų buried · 9 hydrogen bonds · protein-nucleic
  • A–D · 461 Ų buried · 12 hydrogen bonds · protein-nucleic
  • A–C · 399 Ų buried · 10 hydrogen bonds · protein-nucleic
  • B–W · 391 Ų buried · 10 hydrogen bonds · protein-nucleic

Compared structures

  • 3IGM · A 2.2A crystal structure of the AP2 domain of PF14_0633 from P. falciparum, bound as a… · the same entry in another collection · chain B against B, TM-score 1.00

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