6J06: Intracellular B30.2 domain of BTN3A1

Crystal structure of intracellular B30.2 domain of BTN3A1 in complex with HMBPP-08. Determined by X-ray diffraction at 2.65 Å resolution. Released 3 Apr 2019.

Method
X-ray diffraction
Resolution
2.65 Å
Organism
Homo sapiens
Chains
3
Atoms
4,891
Mol. weight
70.52 kDa
Ligands
99C, FLC, CA
Released
3 Apr 2019

Explore 6J06 in 3D Show helices and sheets RCSB PDB PDBe

Secondary structure: helices and β-sheets

6J06 contains 11 α-helices and 51 β-strands across 3 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: 5 helices, 17 β-strands

ElementResiduesLengthSheet
α-helix298-3069
β-strand308-30921
α-helix3101
β-strand31412
α-helix316-3183
β-strand323-32531
β-strand331-33441
β-strand353-35533
β-strand35612
β-strand36013
β-strand364-37071
β-strand377-38373
β-strand400-40673
β-strand410-41343
β-strand419-42133
β-strand429-43571
β-strand440-44561
β-strand451-45551
β-strand464-46963
α-helix4771
β-strand478-48141
α-helix4821
Chain B: 3 helices, 17 β-strands
ElementResiduesLengthSheet
α-helix298-3069
β-strand308-30924
β-strand31415
α-helix316-3183
β-strand323-32534
β-strand331-33444
β-strand353-35536
β-strand35615
β-strand36016
β-strand364-37074
β-strand377-38376
α-helix396-3983
β-strand400-40676
β-strand410-41346
β-strand419-42136
β-strand430-43564
β-strand440-44564
β-strand451-45554
β-strand464-46966
β-strand478-48144
Chain C: 3 helices, 17 β-strands
ElementResiduesLengthSheet
α-helix298-3069
β-strand308-30927
β-strand31418
α-helix316-3183
β-strand323-32537
β-strand331-33447
β-strand353-35539
β-strand35618
β-strand36019
β-strand364-37077
β-strand377-38379
β-strand400-40679
β-strand410-41349
β-strand419-42139
β-strand430-43567
β-strand440-44567
β-strand451-45557
β-strand464-46969
α-helix476-4772
β-strand478-48147

Molecules and chains

MoleculeChainsTypeLengthOrganismUniProt
Butyrophilin subfamily 3 member A1A, B, Cprotein196Homo sapiensO00481 (AlphaFold model)
Sequence of entity 1 (A, B, C), FASTA
>6J06_1 Butyrophilin subfamily 3 member A1 (chains A, B, C)
MGAYNEWKKALFKPADVILDPKTANPILLVSEDQRSVQRAKEPQDLPDNPERFNWHYCVL
GCESFISGRHYWEVEVGDRKEWHIGVCSKNVQRKGWVKMTPENGFWTMGLTDGNKYRTLT
EPRTNLKLPKPPKKVGVFLDYETGDISFYNAVDGSHIHTFLDVSFSEALYPVFRILTLEP
TALTICPALEHHHHHH

Ligands and cofactors

IDNameFormulaCopies
99C(2E)-3-(hydroxymethyl)-4-(4-methylphenyl)but-2-en-1-yl trihydrogen diphosphateC12 H18 O8 P23
FLCCitrate anionC6 H5 O71
CACalcium ionCa1

Water and common crystallization additives (SO4) are not listed.

Primary citation

A Structural Change in Butyrophilin upon Phosphoantigen Binding Underlies Phosphoantigen-Mediated V gamma 9V delta 2 T Cell Activation. Yang, Y., Li, L., Yuan, L. et al. Immunity (2019) 50:1043. DOI 10.1016/j.immuni.2019.02.016 · PubMed

Other PDB entries of the same protein (UniProt O00481 (AlphaFold model), which also has an AlphaFold model), best resolution first:

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