2024-06-29_00000132
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ligand
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8SJB
Crystal structure of Zn2+ bound calprotectin variant H87C;
X-ray diffraction 1.74Å
Protein #1
88 residues (100% resolved)
Raw Sequence ...
MLTELEKALNSIIDVYNKYSLIKGNFNAVYRDDLKKLLETESPQYIRKKGADVWFKELDINTDGAVNFQEFLILVIKMGVAAHKKSCE
Canonical Sequence ...
MLTELEKALNSIIDVYNKYSLIKGNFNAVYRDDLKKLLETESPQYIRKKGADVWFKELDINTDGAVNFQEFLILVIKMGVAAHKKSCE
Protein #2
99 residues (99% resolved)
Raw Sequence ...
MSQLERNIETIINTFHQYSVKLGHPDTLNQGEFKELVRKDLQNFLKKENKNEKVIEHIMEDLDTNADKQLSFEEFIMLMARLTWASNEKMNEGDEGPGH
Canonical Sequence ...
MSQLERNIETIINTFHQYSVKLGHPDTLNQGEFKELVRKDLQNFLKKENKNEKVIEHIMEDLDTNADKQLSFEEFIMLMARLTWASNEKMNEGDEGPGH
Non polymer #3
2PE
InChI=1S/C18H38O10/c19-1-3-21-5-7-23-9-11-25-13-15-27-17-18-28-16-14-26-12-10-24-8-6-22-4-2-20/h19-20H,1-18H2
InChI=1S/C18H38O10/c19-1-3-21-5-7-23-9-11-25-13-15-27-17-18-28-16-14-26-12-10-24-8-6-22-4-2-20/h19-20H,1-18H2
SMILES: C(COCCOCCOCCOCCOCCOCCOCCOCCO)O
C(COCCOCCOCCOCCOCCOCCOCCOCCO)O
Non polymer #4
CA
InChI=1S/Ca/q+2
InChI=1S/Ca/q+2
SMILES: [Ca+2]
[Ca+2]
Non polymer #5
ZN
InChI=1S/Zn/q+2
InChI=1S/Zn/q+2
SMILES: [Zn+2]
[Zn+2]
Biounit #1
hetero-2-2-mer
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Model
Reference
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