5FBZ: Enzyme subtilase SubHal from Bacillus halmapalus

Structure of subtilase SubHal from Bacillus halmapalus - complex with chymotrypsin inhibitor CI2A. Determined by X-ray diffraction at 1.9 Å resolution. Released 18 May 2016.

Method
X-ray diffraction
Resolution
1.9 Å
Organisms
Bacillus halmapalus, Hordeum vulgare
Chains
5
Atoms
8,682
Mol. weight
107.73 kDa
Ligands
CA
Released
18 May 2016

Explore 5FBZ in 3D Show helices and sheets RCSB PDB PDBe

Secondary structure: helices and β-sheets

5FBZ contains 40 α-helices and 74 β-strands across 5 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: 18 helices, 28 β-strands

ElementResiduesLengthSheet
α-helix2-76
α-helix10-178
β-strand25-3061
β-strand50-5561
α-helix68-7710
β-strand90-9561
α-helix110-11910
β-strand124-12741
β-strand129-13022
β-strand13113
α-helix139-15012
β-strand154-15851
α-helix169-1702
β-strand17113
β-strand179-18461
α-helix189-1913
α-helix193-1953
β-strand20111
α-helix2021
β-strand219-22241
β-strand226-22944
α-helix230-2312
α-helix236-2383
β-strand241-24444
β-strand247-25044
β-strand25215
α-helix253-27422
α-helix281-29111
α-helix2921
β-strand29311
α-helix2941
β-strand30811
α-helix311-3155
β-strand318-32146
β-strand32617
β-strand331-33888
β-strand344-34966
α-helix352-3565
β-strand366-37278
β-strand378-38038
β-strand38519
β-strand398-40366
α-helix406-4072
β-strand409-419118
β-strand42517
β-strand428-43256
Chain B: 2 helices, 9 β-strands
ElementResiduesLengthSheet
β-strand23110
α-helix25-273
β-strand31111
α-helix32-4211
β-strand47-52610
β-strand57-5822
β-strand6015
β-strand65-70610
β-strand75111
β-strand76110
β-strand81-82210
Chain C: 16 helices, 27 β-strands
ElementResiduesLengthSheet
α-helix2-76
α-helix10-178
β-strand25-30612
β-strand50-55612
α-helix68-7710
β-strand90-95612
α-helix110-11910
β-strand124-127412
β-strand129-130213
β-strand131114
α-helix139-15012
β-strand154-158512
α-helix169-1702
β-strand171114
β-strand179-184612
α-helix189-1913
β-strand19219
α-helix193-1953
α-helix2001
β-strand201112
α-helix2021
β-strand219-222412
β-strand226-229415
α-helix236-2383
β-strand241-242215
β-strand247-250415
α-helix253-27422
α-helix281-29111
β-strand293112
β-strand308112
α-helix311-3155
β-strand318-321416
β-strand326117
β-strand331-338818
β-strand344-349616
α-helix352-3543
β-strand366-372718
β-strand378-380318
β-strand398-403616
α-helix406-4072
β-strand409-4191118
β-strand425117
β-strand428-432516
Chain D: 2 helices, 9 β-strands
ElementResiduesLengthSheet
β-strand23119
α-helix25-273
β-strand31120
α-helix32-4211
β-strand47-52621
β-strand57-58213
β-strand65-70621
β-strand75120
β-strand76121
β-strand81119
β-strand82121
Chain E: 2 helices, 1 β-strand
ElementResiduesLengthSheet
α-helix2811
β-strand28218
α-helix2831

Molecules and chains

MoleculeChainsTypeLengthOrganismUniProt
Enzyme subtilase SubHal from Bacillus halmapalusA, Cprotein433Bacillus halmapalusA0A182DWC7 (AlphaFold model)
Subtilisin-chymotrypsin inhibitor-2AB, Dprotein72Hordeum vulgareP01053 (AlphaFold model)
Autoproteolytic fragment of enzyme subtilase SubHalEprotein5Bacillus halmapalus
Sequence of entity 1 (A, C), FASTA
>5FBZ_1 Enzyme subtilase SubHal from Bacillus halmapalus (chains A, C)
NDVARGIVKADVAQNNFGLYGQGQIVAVADTGLDTGRNDSSMHEAFRGKITALYALGRTN
NANDPNGHGTHVAGSVLGNATNKGMAPQANLVFQSIMDSGGGLGGLPANLQTLFSQAYSA
GARIHTNSWGAPVNGAYTTDSRNVDDYVRKNDMTILFAAGNEGPGSGTISAPGTAKNAIT
VGATENLRPSFGSYADNINHVAQFSSRGPTRDGRIKPDVMAPGTYILSARSSLAPDSSFW
ANHDSKYAYMGGTSMATPIVAGNVAQLREHFVKNRGVTPKPSLLKAALIAGAADVGLGFP
NGNQGWGRVTLDKSLNVAFVNETSPLSTSQKATYSFTAQAGKPLKISLVWSDAPGSTTAS
LTLVNDLDLVITAPNGTKYVGNDFTAPYDNNWDGRNNVENVFINAPQSGTYTVEVQAYNV
PVGPQTFSLAIVH
Sequence of entity 2 (B, D), FASTA
>5FBZ_2 Subtilisin-chymotrypsin inhibitor-2A (chains B, D)
TGAGDRHNLKTEWPELVGKSVEEAKKVILQDKPEAQIIVLPVGTIVTMEYRIDRVRLFVD
KLDNIAEVPRVG
Sequence of entity 3 (E), FASTA
>5FBZ_3 Autoproteolytic fragment of enzyme subtilase SubHal (chains E)
KPSLL

Ligands and cofactors

IDNameFormulaCopies
CACalcium ionCa6

Primary citation

Stabilization of Enzymes by Metal Binding: Structures of Two Alkalophilic Bacillus Subtilases and Analysis of the Second Metal-Binding Site of the Subtilase Family. Dohnalek, J., McAuley, K.E., Brzozowski, A.M. et al. Book (2016):203-266. DOI 10.4032/9789814669337

Other PDB entries of the same protein (UniProt A0A182DWC7 (AlphaFold model), which also has an AlphaFold model), best resolution first:

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