2026-05-09_00000001
|
ligand
|
10AK
Crystal Structure of Human WRN helicase with compound 4;
X-ray diffraction 1.37Å
Protein #1
431 residues (98% resolved)
Raw Sequence ...
ANEGEEDDDKDFLWPAPNEEQVTCLKMYFGHSSFKPVQWKVIHSVLEERRDNVAVMATGYGKSLCFQYPPVYVGKIGLVISPLISLMEDQVLQLKMSNIPACFLGSAQSENVLTDIKLGKYRIVYVTPEYCSGNMGLLQQLEADIGITLIAVDEAHCISEWGHDFRDSFRKLGSLKTALPMVPIVALTATASSSIREDIVRCLNLRNPQITCTGFDRPNLYLEVRRKTGNILQDLQPFLVKTSSHWEFEGPTIIYCPSRKMTQQVTGELRKLNLSCGTYHAGMSFSTRKDIHHRFVRDEIQCVIATIAFGMGINKADIRQVIHYGAPKDMESYYQEIGRAGRDGLQSSCHVLWAPADINLNRHLLTEIRNEKFRLYKLKMMAKMEKYLHSSRCRRQIILSHFEDKQVQKASLGIMGTEKCCDNCRSRLDHC
Canonical Sequence ...
ANEGEEDDDKDFLWPAPNEEQVTCLKMYFGHSSFKPVQWKVIHSVLEERRDNVAVMATGYGKSLCFQYPPVYVGKIGLVISPLISLMEDQVLQLKMSNIPACFLGSAQSENVLTDIKLGKYRIVYVTPEYCSGNMGLLQQLEADIGITLIAVDEAHCISEWGHDFRDSFRKLGSLKTALPMVPIVALTATASSSIREDIVRCLNLRNPQITCTGFDRPNLYLEVRRKTGNILQDLQPFLVKTSSHWEFEGPTIIYCPSRKMTQQVTGELRKLNLSCGTYHAGMSFSTRKDIHHRFVRDEIQCVIATIAFGMGINKADIRQVIHYGAPKDMESYYQEIGRAGRDGLQSSCHVLWAPADINLNRHLLTEIRNEKFRLYKLKMMAKMEKYLHSSRCRRQIILSHFEDKQVQKASLGIMGTEKCCDNCRSRLDHC
Non polymer #2
A1C4L
InChI=1S/C23H24N2O3S/c26-23(16-19-8-10-21(11-9-19)24-13-4-5-14-24)25(17-20-6-2-1-3-7-20)22-12-15-29(27,28)18-22/h1-11,13-14,22H,12,15-18H2/t22-/m1/s1
InChI=1S/C23H24N2O3S/c26-23(16-19-8-10-21(11-9-19)24-13-4-5-14-24)25(17-20-6-2-1-3-7-20)22-12-15-29(27,28)18-22/h1-11,13-14,22H,12,15-18H2/t22-/m1/s1
SMILES: c1ccc(cc1)CN([C@@H]2CCS(=O)(=O)C2)C(=O)Cc3ccc(cc3)n4cccc4
c1ccc(cc1)CN([C@@H]2CCS(=O)(=O)C2)C(=O)Cc3ccc(cc3)n4cccc4
Non polymer #3
CL
InChI=1S/ClH/h1H/p-1
InChI=1S/ClH/h1H/p-1
SMILES: [Cl-]
[Cl-]
Non polymer #4
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 #5
ZN
InChI=1S/Zn/q+2
InChI=1S/Zn/q+2
SMILES: [Zn+2]
[Zn+2]
Biounit #1
monomer
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Model
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