2025-03-29_00000442|ligand|9K3G

Crystal structure of Sortase A from Streptococcus pyogenes in complex with T10; X-ray diffraction 1.23Å
Protein #1 189 residues (83% resolved)

MGSSHHHHHHSSGLVPRGSHMVLQAQMAAQQLPVIGGIAIPELGINLPIFKGLGNTELIYGAGTMKEEQVMGGENNYSLASHHIFGITGSSQMLFSPLERAQNGMSIYLTDKEKIYEYIIKDVFTVAPERVDVIDDTAGLKEVTLVTCTDIEATERIIVKGELKTEYDFDKAPADVLKAFNHSYNQVST

MGSSHHHHHHSSGLVPRGSHMVLQAQMAAQQLPVIGGIAIPELGINLPIFKGLGNTELIYGAGTMKEEQVMGGENNYSLASHHIFGITGSSQMLFSPLERAQNGMSIYLTDKEKIYEYIIKDVFTVAPERVDVIDDTAGLKEVTLVTCTDIEATERIIVKGELKTEYDFDKAPADVLKAFNHSYNQVST
Non polymer #2 A1EEN

InChI=1S/C25H25N3O7/c1-15(2)12-20(26-25(33)34-14-17-6-4-3-5-7-17)23(31)35-18-10-8-16(9-11-18)13-19-21(29)27-24(32)28-22(19)30/h3-11,13,15,20H,12,14H2,1-2H3,(H,26,33)(H2,27,28,29,30,32)/t20-/m0/s1

CC(C)C[C@@H](C(=O)Oc1ccc(cc1)C=C2C(=O)NC(=O)NC2=O)NC(=O)OCc3ccccc3
Non polymer #3 MG

InChI=1S/Mg/q+2

[Mg+2]
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Reference