2025-02-15_00000164|medium|9GDJ

C-Methyltransferase SgMT from Streptomyces griseoviridis; X-ray diffraction 1.47Å

Protein #1 291 residues (91% resolved)

Raw Sequence ...

MGSSHHHHHHSSGLVPRGSHMSSQTVTPDPYGNLAESYDRLAQWAIDQQQESPRDRVGDFLQTFWQSQDRPVRTVLEICCGTGLMLAELARRGYVVTGLDRSAAMLEQARARMGGKTTLIRAELPDIPAPAGEFDAVVSAAGGLNYLSESQISATFGAVARLLPAGGTFTFDVFGQGFYAKFFDPSAPRVMALELDDISYIWTFTKPAEAPFVDMSYTQFSPASRAVDGEPAFIRTRDLHRYYPLPHATVLRLAAEHGFTDARAHDNYSSDPSGPHTLYDTWTMVRTGSLE

Canonical Sequence ...

Non polymer #2 CL

InChI=1S/ClH/h1H/p-1

SMILES: [Cl-]

[Cl-]

Non polymer #3 IPA

InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3

SMILES: CC(C)O

CC(C)O

Non polymer #4 NCO

InChI=1S/Co.6H3N/h;6*1H3/q+3;;;;;;

SMILES: [NH3][Co+3]([NH3])([NH3])([NH3])([NH3])[NH3]

[NH3][Co+3]([NH3])([NH3])([NH3])([NH3])[NH3]

Non polymer #5 PGE

InChI=1S/C6H14O4/c7-1-3-9-5-6-10-4-2-8/h7-8H,1-6H2

SMILES: C(COCCOCCO)O

C(COCCOCCO)O

Non polymer #6 SAH

InChI=1S/C14H20N6O5S/c15-6(14(23)24)1-2-26-3-7-9(21)10(22)13(25-7)20-5-19-8-11(16)17-4-18-12(8)20/h4-7,9-10,13,21-22H,1-3,15H2,(H,23,24)(H2,16,17,18)/t6-,7+,9+,10+,13+/m0/s1

SMILES: c1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)CSCC[C@@H](C(=O)O)N)O)O)N

c1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)CSCC[C@@H](C(=O)O)N)O)O)N

Biounit #1 homo-dimer

Biounit #2 homo-dimer

Reference