9BOL: Elongin-B

Crystal structure of the complex between VHL, ElonginB, ElonginC, and compound 5. Determined by X-ray diffraction at 1.99 Å resolution. Released 29 May 2024.

Method
X-ray diffraction
Resolution
1.99 Å
Organism
Homo sapiens
Chains
6
Atoms
5,970
Mol. weight
87.8 kDa
Ligands
A1ARP
Released
29 May 2024

Explore 9BOL in 3D Show helices and sheets RCSB PDB PDBe

Secondary structure: helices and β-sheets

9BOL contains 39 α-helices and 54 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, 13 β-strands

ElementResiduesLengthSheet
β-strand2-981
β-strand1012
β-strand12-1981
β-strand2313
α-helix24-3512
α-helix39-413
β-strand42-4651
β-strand49-5021
α-helix51-522
β-strand5613
α-helix57-604
β-strand6814
β-strand7114
α-helix721
β-strand73-7971
β-strand8015
β-strand8515
α-helix86-872
β-strand9012
α-helix91-10010
α-helix101-1033
Chain B: 5 helices, 3 β-strands
ElementResiduesLengthSheet
β-strand18-2251
β-strand28-3251
α-helix33-364
α-helix40-467
β-strand59-6131
α-helix67-8317
α-helix89-924
α-helix97-11014
Chain C: 7 helices, 11 β-strands
ElementResiduesLengthSheet
β-strand71-7886
α-helix831
β-strand84-8967
β-strand95-9737
β-strand10117
β-strand106-11276
β-strand116-12167
β-strand12717
β-strand129-13026
β-strand13316
β-strand13617
α-helix140-1412
α-helix145-1462
β-strand147-15266
α-helix158-16912
α-helix172-1776
α-helix182-1898
α-helix194-20815
Chain D: 7 helices, 13 β-strands
ElementResiduesLengthSheet
β-strand2-988
β-strand1019
β-strand12-1988
β-strand23110
α-helix24-3512
α-helix39-413
β-strand42-4658
β-strand49-5028
α-helix51-522
β-strand56110
β-strand68111
β-strand71111
α-helix721
β-strand73-7978
β-strand80-81212
β-strand84-85212
α-helix86-883
β-strand9019
α-helix91-988
α-helix101-1033
Chain E: 6 helices, 3 β-strands
ElementResiduesLengthSheet
β-strand18-2258
β-strand28-3258
α-helix33-364
α-helix40-456
β-strand59-6138
α-helix67-8317
α-helix89-924
α-helix97-993
α-helix100-11011
Chain F: 6 helices, 11 β-strands
ElementResiduesLengthSheet
β-strand71-78813
α-helix831
β-strand84-89614
β-strand95-97314
β-strand101114
β-strand106-112713
β-strand116-121614
β-strand127114
β-strand129-130213
β-strand133113
β-strand136114
α-helix145-1462
β-strand147-152613
α-helix158-16912
α-helix172-1776
α-helix182-1898
α-helix194-20512

Molecules and chains

MoleculeChainsTypeLengthOrganismUniProt
Elongin-BA, Dprotein104Homo sapiensQ15370 (AlphaFold model)
Elongin-CB, Eprotein96Homo sapiensQ15369 (AlphaFold model)
von Hippel-Lindau disease tumor suppressorC, Fprotein176Homo sapiensP40337 (AlphaFold model)
Sequence of entity 1 (A, D), FASTA
>9BOL_1 Elongin-B (chains A, D)
MDVFLMIRRHKTTIFTDAKESSTVFELKRIVEGILKRPPDEQRLYKDDQLLDDGKTLGEC
GFTSQTARPQAPATVGLAFRADDTFEALCIEPFSSPPELPDVMK
Sequence of entity 2 (B, E), FASTA
>9BOL_2 Elongin-C (chains B, E)
MYVKLISSDGHEFIVKREHALTSGTIKAMLSGPGQFAENETNEVNFREIPSHVLSKVCMY
FTYKVRYTNSSTEIPEFPIAPEIALELLMAANFLDC
Sequence of entity 3 (C, F), FASTA
>9BOL_3 von Hippel-Lindau disease tumor suppressor (chains C, F)
MHHHHHHGENLYFQGSMEAGRPRPVLRSVNSREPSQVIFCNRSPRVVLPVWLNFDGEPQP
YPTLPPGTGRRIHSYRGHLWLFRDAGTHDGLLVNQTELFVPSLNVDGQPIFANITLPVYT
LKERCLQVVRSLVKPENYRRLDIVRSLYEDLEDHPNVQKDLERLTQERIAHQRMGD

Ligands and cofactors

IDNameFormulaCopies
A1ARP(4R)-1-[(2S)-2-(4-cyclopropyl-1H-1,2,3-triazol-1-yl)-3,3-dimethylbutanoyl]-4-hy…C27 H34 N6 O3 S2

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

Primary citation

Potency-Enhanced Peptidomimetic VHL Ligands with Improved Oral Bioavailability. Wu, H., Murray, J., Ishisoko, N. et al. J Med Chem (2024) 67:8585-8608. DOI 10.1021/acs.jmedchem.3c02203 · PubMed

Other PDB entries of the same protein (UniProt Q15370 (AlphaFold model), which also has an AlphaFold model), best resolution first:

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