2025-01-18_00000068|ligand|8XXC

DaCS-intermediate complex; X-ray diffraction 2.03Å
Protein #1 435 residues (100% resolved)

SFLKEKLAEKIAQHRPRTTRLLSEFGNVKIDEVTISQAIGGMRGIKSLVTDISYLDPEEGIRFRGYTIPEVLEKLPKVPGAEMPYVEGHFYLLLTGDVPTEKEVKEVAEEFKKRRALPEYVKDTLKAMPRDTHPMTMFAAGILAMQRESKFAAYYNAGKFNKNTAWEPMFEDAMDLMARLPSLGAYIYRMKYKSDTHIPSNPDLDLGGDFANMMGIDKPYDDVARLYFILHSDHESGNVSAHTAHLVASALSDAYYAYSAAMCGLAGPLHGLANQEVLKWIQETIDKKLGGKVPTKEELKKFVEETLSSGQVIPGYGHAVLRKTDPRYVAQREFALKHMPDDPIFQVVSMLYEVVPPILSSLGKVKDPWPNVDAHSGCIQWHYGVVEYDFYTVLFGIGRALGVLANLVWDRALGYAIERPKSVTTDMLEKWAGIK

SFLKEKLAEKIAQHRPRTTRLLSEFGNVKIDEVTISQAIGGMRGIKSLVTDISYLDPEEGIRFRGYTIPEVLEKLPKVPGAEMPYVEGHFYLLLTGDVPTEKEVKEVAEEFKKRRALPEYVKDTLKAMPRDTHPMTMFAAGILAMQRESKFAAYYNAGKFNKNTAWEPMFEDAMDLMARLPSLGAYIYRMKYKSDTHIPSNPDLDLGGDFANMMGIDKPYDDVARLYFILHSDHESGNVSAHTAHLVASALSDAYYAYSAAMCGLAGPLHGLANQEVLKWIQETIDKKLGGKVPTKEELKKFVEETLSSGQVIPGYGHAVLRKTDPRYVAQREFALKHMPDDPIFQVVSMLYEVVPPILSSLGKVKDPWPNVDAHSGCIQWHYGVVEYDFYTVLFGIGRALGVLANLVWDRALGYAIERPKSVTTDMLEKWAGIK
Non polymer #2 ACY

InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)

CC(=O)O
Non polymer #3 CIT

InChI=1S/C6H8O7/c7-3(8)1-6(13,5(11)12)2-4(9)10/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)

C(C(=O)O)C(CC(=O)O)(C(=O)O)O
Non polymer #4 OAA

InChI=1S/C4H4O5/c5-2(4(8)9)1-3(6)7/h1H2,(H,6,7)(H,8,9)/p-1

C(C(=O)C(=O)O)C(=O)[O-]
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Reference