3F78: Wild type LFA1 I domain

Crystal structure of wild type LFA1 I domain complexed with isoflurane. Determined by X-ray diffraction at 1.6 Å resolution. Released 23 Jun 2009.

Method
X-ray diffraction
Resolution
1.6 Å
Organism
Homo sapiens
Chains
3
Atoms
5,147
Mol. weight
62.98 kDa
Ligands
MG, ICF
Released
23 Jun 2009

Explore 3F78 in 3D Show helices and sheets RCSB PDB PDBe

Secondary structure: helices and β-sheets

3F78 contains 39 α-helices and 24 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: 12 helices, 8 β-strands

ElementResiduesLengthSheet
β-strand130-13781
β-strand13912
α-helix144-16017
β-strand166-17381
β-strand177-18151
α-helix183-1897
α-helix192-1954
β-strand20412
α-helix208-21811
α-helix222-2243
β-strand231-23881
α-helix249-2513
β-strand255-26171
α-helix263-2653
α-helix268-2725
α-helix275-2773
α-helix282-2854
β-strand286-28941
α-helix292-2987
α-helix299-3046
Chain B: 13 helices, 8 β-strands
ElementResiduesLengthSheet
β-strand130-13783
β-strand13914
α-helix144-16017
β-strand166-17383
β-strand177-18153
α-helix183-1897
α-helix192-1954
β-strand20414
α-helix208-2147
α-helix215-2195
α-helix222-2243
β-strand231-23883
α-helix249-2513
β-strand255-26173
α-helix263-2653
α-helix268-2725
α-helix275-2773
α-helix282-2854
β-strand286-28943
α-helix292-2987
α-helix299-3046
Chain C: 14 helices, 8 β-strands
ElementResiduesLengthSheet
β-strand130-13785
β-strand13916
α-helix144-16017
β-strand166-17385
β-strand177-18155
α-helix183-1897
α-helix192-1954
β-strand20416
α-helix208-2147
α-helix215-2195
α-helix222-2243
β-strand231-23885
α-helix249-2513
β-strand255-26175
α-helix263-2653
α-helix268-2725
α-helix275-2773
α-helix2791
α-helix2811
α-helix282-2854
β-strand286-28945
α-helix292-30211

Molecules and chains

MoleculeChainsTypeLengthOrganismUniProt
Integrin alpha-LA, B, Cprotein181Homo sapiensP20701 (AlphaFold model)
Sequence of entity 1 (A, B, C), FASTA
>3F78_1 Integrin alpha-L (chains A, B, C)
MGNVDLVFLFDGSMSLQPDEFQKILDFMKDVMKKLSNTSYQFAAVQFSTSYKTEFDFSDY
VKWKDPDALLKHVKHMLLLTNTFGAINYVATEVFREELGARPDATKVLIIITDGEATDSG
NIDAAKDIIRYIIGIGKHFQTKESQETLHKFASKPASEFVKILDTFEKLKDLFTELQKKI
Y

Ligands and cofactors

IDNameFormulaCopies
MGMagnesium ionMg1
ICF1-chloro-2,2,2-trifluoroethyl difluoromethyl etherC3 H2 Cl F5 O2

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

Primary citation

Crystal structure of isoflurane bound to integrin LFA-1 supports a unified mechanism of volatile anesthetic action in the immune and central nervous systems. Zhang, H., Astrof, N.S., Liu, J.H. et al. FASEB J (2009) 23:2735-2740. DOI 10.1096/fj.09-129908 · PubMed

Other PDB entries of the same protein (UniProt P20701 (AlphaFold model), which also has an AlphaFold model), best resolution first:

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