8GJF: Afupcna

afupcna bound with peptide mimetic. Determined by X-ray diffraction at 2.0 Å resolution. Released 24 Jan 2024.

Method
X-ray diffraction
Resolution
2.0 Å
Organisms
Aspergillus fumigatus, synthetic construct
Chains
6
Atoms
6,392
Mol. weight
90.04 kDa
Released
24 Jan 2024

Explore 8GJF in 3D Show helices and sheets RCSB PDB PDBe

Secondary structure: helices and β-sheets

8GJF contains 29 α-helices and 72 β-strands across 6 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: 8 helices, 22 β-strands

ElementResiduesLengthSheet
β-strand2-651
α-helix10-178
β-strand25-3172
β-strand34-4072
β-strand46-5382
α-helix54-563
β-strand59-6241
β-strand66-7162
α-helix72-798
β-strand87-9261
β-strand98-10471
β-strand111-11771
α-helix1181
β-strand12613
β-strand135-14062
α-helix141-15212
β-strand157-16264
β-strand166-17274
β-strand176-18384
β-strand18515
β-strand19415
β-strand196-19942
β-strand203-20864
α-helix209-2157
α-helix216-2216
β-strand224-23072
β-strand233-24082
β-strand244-25072
α-helix251-2522
β-strand253-25424
Chain B: 9 helices, 22 β-strands
ElementResiduesLengthSheet
β-strand2-656
α-helix10-2011
β-strand25-3177
β-strand34-4077
β-strand46-5387
α-helix54-563
β-strand60-6236
β-strand66-7167
α-helix72-798
β-strand87-9266
β-strand98-10476
β-strand111-11776
α-helix1181
β-strand12618
β-strand135-14067
α-helix141-15212
β-strand157-16261
β-strand166-17271
β-strand176-18381
β-strand18519
α-helix191-1933
β-strand19519
β-strand196-19947
β-strand203-20861
α-helix209-2157
α-helix216-2216
β-strand224-22967
β-strand235-24067
β-strand244-25077
α-helix251-2522
β-strand25311
Chain C: 9 helices, 22 β-strands
ElementResiduesLengthSheet
β-strand2-654
α-helix10-1910
β-strand25-31710
β-strand34-40710
β-strand46-53810
α-helix54-563
β-strand60-6124
β-strand66-71610
α-helix72-798
β-strand87-9264
β-strand98-10474
β-strand111-11774
α-helix1181
β-strand125-126211
β-strand135-140610
α-helix141-15212
β-strand157-16266
β-strand166-17386
β-strand176-18386
β-strand185112
α-helix191-1933
β-strand195112
β-strand196-199410
β-strand203-20866
α-helix209-2157
α-helix216-2216
β-strand224-229610
β-strand235-240610
β-strand244-250710
α-helix251-2522
β-strand25316
Chain D: 1 helix, 2 β-strands
ElementResiduesLengthSheet
β-strand143-14424
α-helix147-1493
β-strand15313
Chain E: 1 helix, 2 β-strands
ElementResiduesLengthSheet
β-strand14411
α-helix147-1493
β-strand15318
Chain F: 1 helix, 2 β-strands
ElementResiduesLengthSheet
β-strand14416
α-helix147-1493
β-strand153-154211

Molecules and chains

MoleculeChainsTypeLengthOrganismUniProt
Proliferating cell nuclear antigenA, B, Cprotein256Aspergillus fumigatusA0A229Y5V5 (AlphaFold model)
Lys-arg-arg-gln-thr-ser-met-thr-asp-phe-tyr-his-ser-lys-argD, E, Fprotein15synthetic constructP38936 (AlphaFold model)
Sequence of entity 1 (A, B, C), FASTA
>8GJF_1 Proliferating cell nuclear antigen (chains A, B, C)
MLEARLEQASLLKRVVDAIKDLVQDCNFDCNDSGIALQAMDNSHVALVSMLLKAEGFSAY
RCDRNIALGINLVSLTKVLRAAQNEDILTLKADDSPDAVNLMFESAETDRISEYDIKLMD
IDQEHLAIPETEYAATVEMPSAEFQRICRDLNALSESVVIEATKEGVKFSCQGDIGSGSV
TIRQHTSVDKPEQNVSIALSEPVALTFSLKYLVNFCKATSLSSKVTLCLSQEVPLLVEYG
LGSGHLRFYLAPKIGD
Sequence of entity 2 (D, E, F), FASTA
>8GJF_2 LYS-ARG-ARG-GLN-THR-SER-MET-THR-ASP-PHE-TYR-HIS-SER-LYS-ARG (chains D, E, F)
KRRQTSMTDFYHSKR

Primary citation

Towards a High-Affinity Peptidomimetic Targeting Proliferating Cell Nuclear Antigen from Aspergillus fumigatus. Vandborg, B.C., Horsfall, A.J., Pederick, J.L. et al. J Fungi (Basel) (2023) 9. DOI 10.3390/jof9111098 · PubMed

Other PDB entries of the same protein (UniProt A0A229Y5V5 (AlphaFold model), which also has an AlphaFold model), best resolution first:

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