2024-11-02_00000040
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ligand
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7HH4
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z1139246057;
X-ray diffraction 1.49Å
Protein #1
94 residues (99% resolved)
Raw Sequence ...
GMPHAFKPGDLVFAKMKGYPHWPARIDDIADGAVKPPPNKYPIFFFGTHETAFLGPKDLFPYDKSKDKYGKPNKRKGFNEGLWEIQNNPHASYS
Canonical Sequence ...
GMPHAFKPGDLVFAKMKGYPHWPARIDDIADGAVKPPPNKYPIFFFGTHETAFLGPKDLFPYDKSKDKYGKPNKRKGFNEGLWEIQNNPHASYS
Non polymer #2
A1A39
InChI=1S/C10H16N4/c1-11-9-4-3-7-14(8-9)10-5-2-6-12-13-10/h2,5-6,9,11H,3-4,7-8H2,1H3/t9-/m1/s1
InChI=1S/C10H16N4/c1-11-9-4-3-7-14(8-9)10-5-2-6-12-13-10/h2,5-6,9,11H,3-4,7-8H2,1H3/t9-/m1/s1
SMILES: CN[C@H]1CCCN(C1)c2cccnn2
CN[C@H]1CCCN(C1)c2cccnn2
Non polymer #3
EDO
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
SMILES: C(CO)O
C(CO)O
Non polymer #4
W0J
InChI=1S/C10H16N4/c1-11-9-4-3-7-14(8-9)10-5-2-6-12-13-10/h2,5-6,9,11H,3-4,7-8H2,1H3/t9-/m1/s1
InChI=1S/C10H16N4/c1-11-9-4-3-7-14(8-9)10-5-2-6-12-13-10/h2,5-6,9,11H,3-4,7-8H2,1H3/t9-/m1/s1
SMILES: CN[C@@H]1CCCN(C1)c2cccnn2
CN[C@@H]1CCCN(C1)c2cccnn2
Biounit #1
monomer
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Biounit #2
monomer
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Biounit #3
monomer
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