2026-02-07_00000130
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ligand
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9OOC
Crystal structure of MYST acetyltransferase domain in complex with inhibitor 10a;
X-ray diffraction 2.10Å
Protein #1
295 residues (91% resolved)
Raw Sequence ...
MGSSHHHHHHSSGLVPRGSTKVKYVDKIHIGNYEIDAWYFSPFPEDYGKQPKLWLCEYCLKYMKYEKSYRFHLGQCQWRQPPGKEIYRKSNISVHEVDGKDHKIYCQNLCLLAKLFLDH(ALY)TLYFDVEPFVFYILTEVDRQGAHIVGYFSKEKESPDGNNVSCIMILPPYQRRGYGRFLIAFSYELSKLESTVGSPEKPLSDLGKLSYRSYWSSVLLENLRDFRGTLSIKDLSQMTSITQNDIISTLQSLNMVKYWKGQHVICVTPKLVEEHLKSAQYKKPPITVDSVCLKWAPPK
Canonical Sequence ...
MGSSHHHHHHSSGLVPRGSTKVKYVDKIHIGNYEIDAWYFSPFPEDYGKQPKLWLCEYCLKYMKYEKSYRFHLGQCQWRQPPGKEIYRKSNISVHEVDGKDHKIYCQNLCLLAKLFLDHKTLYFDVEPFVFYILTEVDRQGAHIVGYFSKEKESPDGNNVSCIMILPPYQRRGYGRFLIAFSYELSKLESTVGSPEKPLSDLGKLSYRSYWSSVLLENLRDFRGTLSIKDLSQMTSITQNDIISTLQSLNMVKYWKGQHVICVTPKLVEEHLKSAQYKKPPITVDSVCLKWAPPK
Non polymer #2
A1CDJ
InChI=1S/C22H21FN2O4S/c1-15-11-18(17-8-4-3-5-9-17)13-20(21(15)23)22(26)24-25-30(27,28)19-10-6-7-16(12-19)14-29-2/h3-13,25H,14H2,1-2H3,(H,24,26)
InChI=1S/C22H21FN2O4S/c1-15-11-18(17-8-4-3-5-9-17)13-20(21(15)23)22(26)24-25-30(27,28)19-10-6-7-16(12-19)14-29-2/h3-13,25H,14H2,1-2H3,(H,24,26)
SMILES: Cc1cc(cc(c1F)C(=O)NNS(=O)(=O)c2cccc(c2)COC)c3ccccc3
Cc1cc(cc(c1F)C(=O)NNS(=O)(=O)c2cccc(c2)COC)c3ccccc3
Non polymer #3
CL
InChI=1S/ClH/h1H/p-1
InChI=1S/ClH/h1H/p-1
SMILES: [Cl-]
[Cl-]
Non polymer #4
ZN
InChI=1S/Zn/q+2
InChI=1S/Zn/q+2
SMILES: [Zn+2]
[Zn+2]
Biounit #1
monomer
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Model
Reference
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