4DZ3: Peptidyl-prolyl cis-trans isomerase

Crystal structure of a Peptidyl-prolyl cis-trans isomerase with surface mutation M61H from Burkholderia pseudomallei complexed with FK506. Determined by X-ray diffraction at 2.0 Å resolution. Released 28 Mar 2012.

Method
X-ray diffraction
Resolution
2.0 Å
Organism
Burkholderia pseudomallei
Chains
2
Atoms
1,944
Mol. weight
26.16 kDa
Ligands
CA, FK5
Released
28 Mar 2012

Explore 4DZ3 in 3D Show helices and sheets RCSB PDB PDBe

Secondary structure: helices and β-sheets

4DZ3 contains 9 α-helices and 22 β-strands across 2 chains. Residue ranges use author residue numbering, as in the PDB file, from PDBe. To see them in 3D, choose the Cartoon representation with Secondary structure coloring: helices, sheets and coils get different colors.

Chain A: 4 helices, 11 β-strands

ElementResiduesLengthSheet
β-strand3-531
β-strand11-1661
α-helix211
β-strand2212
α-helix231
β-strand28-37101
β-strand42-4541
β-strand53-5641
α-helix64-696
β-strand7412
β-strand78-8361
α-helix85-873
β-strand9413
β-strand9813
β-strand104-11291
Chain B: 5 helices, 11 β-strands
ElementResiduesLengthSheet
β-strand4-524
β-strand11-1664
α-helix211
β-strand2215
α-helix231
β-strand28-37104
β-strand42-4544
α-helix46-494
β-strand53-5644
α-helix64-696
β-strand7415
β-strand78-8364
α-helix85-873
β-strand9416
β-strand9816
β-strand104-11294

Molecules and chains

MoleculeChainsTypeLengthOrganismUniProt
Peptidyl-prolyl cis-trans isomeraseA, Bprotein113Burkholderia pseudomalleiQ3JK38 (AlphaFold model)
Sequence of entity 1 (A, B), FASTA
>4DZ3_1 Peptidyl-prolyl cis-trans isomerase (chains A, B)
STVVTTESGLKYEDLTEGSGAEARAGQTVSVHYTGWLTDGQKFDSSKDRNDPFAFVLGGG
HVIKGWDEGVQGMKVGGVRRLTIPPQLGYGARGAGGVIPPNATLVFEVELLDV

Ligands and cofactors

IDNameFormulaCopies
CACalcium ionCa2
FK58-deethyl-8-[but-3-enyl]-ascomycinC44 H69 N O122

Water and common crystallization additives (ACT, EDO) are not listed.

Primary citation

A structural biology approach enables the development of antimicrobials targeting bacterial immunophilins. Begley, D.W., Fox, D., Jenner, D. et al. Antimicrob Agents Chemother (2014) 58:1458-1467. DOI 10.1128/AAC.01875-13 · PubMed

Other PDB entries of the same protein (UniProt Q3JK38 (AlphaFold model), which also has an AlphaFold model), best resolution first:

Browse structure collections

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