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Crystal structure of mutant ABL kinase domain in complex with small molecule fragment

X-ray diffraction
2.02Å resolution
PDB entry 3dk3 coloured by chain, front view.
PDB entry 3dk3 coloured by chain, side view.
PDB entry 3dk3 coloured by chain, top view.
Source organism: Mus musculus
Assembly composition:
monomeric (preferred)
Entry contents: 1 distinct polypeptide molecule

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Assemblies

Assembly 1
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Assembly Name: Tyrosine-protein kinase ABL1
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Multimeric state: monomeric
Accessible surface area: 13126.0 Å2
Buried surface area: 0.0 Å2
Dissociation area: 0 Å2
Dissociation energy (ΔGdiss): 0 kcal/mol
Dissociation entropy (TΔSdiss): 0 kcal/mol
Symmetry number: 1
PDBe Complex ID: PDB-CPX-132624
Assembly 2 (preferred)
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Assembly Name: Tyrosine-protein kinase ABL1
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Multimeric state: monomeric
Accessible surface area: 12969.07 Å2
Buried surface area: 186.35 Å2
Dissociation area: 93.18 Å2
Dissociation energy (ΔGdiss): 14.11 kcal/mol
Dissociation entropy (TΔSdiss): 0.59 kcal/mol
Symmetry number: 1
PDBe Complex ID: PDB-CPX-132624

Macromolecules

Tyrosine-protein kinase ABL1
Chains: A, B
Length: 293 amino acids
Theoretical weight: 33.94 KDa
Source organism: Mus musculus
Expression system: Escherichia coli
UniProt:
  • Canonical: P00520 (Residues: 233-514; Coverage: 25%)
Gene names: Abl, Abl1
Pfam: Protein tyrosine and serine/threonine kinase
InterPro:
CATH:
Tyrosine-protein kinase ABL1 in PDB entry 3dk3, assembly 2, front view.
Tyrosine-protein kinase ABL1 in PDB entry 3dk3, assembly 2, side view.
Tyrosine-protein kinase ABL1 in PDB entry 3dk3, assembly 2, top view.
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