2025-07-19_00000045|ligand|9E97

L-allo-threonine aldolase from Thermotoga maritima N308E-Y87A-R122G-P121D Mutant with a 2-(aminomethyl)pyridine PLP modification; X-ray diffraction 1.53Å
Protein #1 349 residues (99% resolved)

MIDLRSDTVTKPTEEMRKAMAQAEVGDDVYGEDPTINELERLAAETFGKEAALFVPSGTMGNQVSIMAHTQRGDEVILEADSHIFWAEVGAMAVLSGVMPHPVPGKNGAMDPDDVRKAIRDGNIHFPRTSLIAIENTHNRSGGRVVPLENIKEICTIAKEHGINVHIDGARIFNASIASGVPVKEYAGYADSVMFCLSKGLCAPVGSVVVGDRDFIERARKARKMLGGGMRQAGVLAAAGIIALTKMVDRLKEDHENARFLALKLKEIGYSVNPEDVKTNMVILRTDNLKVNAHGFIEALRNSGVLAEAVSDTEIRLVTHKDVSRNDIEEALNIFEKLFSQVQHHHHHH

MIDLRSDTVTKPTEEMRKAMAQAEVGDDVYGEDPTINELERLAAETFGKEAALFVPSGTMGNQVSIMAHTQRGDEVILEADSHIFWAEVGAMAVLSGVMPHPVPGKNGAMDPDDVRKAIRDGNIHFPRTSLIAIENTHNRSGGRVVPLENIKEICTIAKEHGINVHIDGARIFNASIASGVPVKEYAGYADSVMFCLSKGLCAPVGSVVVGDRDFIERARKARKMLGGGMRQAGVLAAAGIIALTKMVDRLKEDHENARFLALKLKEIGYSVNPEDVKTNMVILRTDNLKVNAHGFIEALRNSGVLAEAVSDTEIRLVTHKDVSRNDIEEALNIFEKLFSQVQHHHHHH
Non polymer #2 1PE

InChI=1S/C10H22O6/c11-1-3-13-5-7-15-9-10-16-8-6-14-4-2-12/h11-12H,1-10H2

C(COCCOCCOCCOCCO)O
Non polymer #3 A1BGC

InChI=1S/C14H16N3O5P/c1-10-14(18)13(8-15-7-12-4-2-3-5-16-12)11(6-17-10)9-22-23(19,20)21/h2-6,8,18H,7,9H2,1H3,(H2,19,20,21)/b15-8+

Cc1c(c(c(cn1)COP(=O)(O)O)/C=N/Cc2ccccn2)O
Non polymer #4 CA

InChI=1S/Ca/q+2

[Ca+2]
Non polymer #5 PEG

InChI=1S/C4H10O3/c5-1-3-7-4-2-6/h5-6H,1-4H2

C(COCCO)O
Non polymer #6 PG4

InChI=1S/C8H18O5/c9-1-3-11-5-7-13-8-6-12-4-2-10/h9-10H,1-8H2

C(COCCOCCOCCO)O
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Reference