2024-01-06_00000079|ligand|8FOS

Crystal Structure of Kemp Eliminase HG3-shell with bound transition state analogue; X-ray diffraction 1.56Å
Protein #1 319 residues (94% resolved)

HGAEAAQSIDQLIKARGKVYFGVATDQNRLTTGKNAAIIKADFGMVWPEESMQWDATEPSQGNFNFAGADYLVNWAQQNGKLIGGGMLVWHNQLPSWVSSITDKNTLINVMKNHITTLMTRYKGKIRAWDVVGEAFNEDGSLRQNVFLNVIGEDYIPIAFQTARAADPNAKLYIMDYNLDSASYPKTQAIVNRVKQWRAAGVPIDGIGSQMHLSAGQGAGVLQALPLLASAGTPEVSILMLDVAGASPTDYVNVVNACLNVQSCVGITVFGVADPDSWRASSTPLLFDGNFNPKPAYNAIVQNLQQGSIEGRGHHHHHH

HGAEAAQSIDQLIKARGKVYFGVATDQNRLTTGKNAAIIKADFGMVWPEESMQWDATEPSQGNFNFAGADYLVNWAQQNGKLIGGGMLVWHNQLPSWVSSITDKNTLINVMKNHITTLMTRYKGKIRAWDVVGEAFNEDGSLRQNVFLNVIGEDYIPIAFQTARAADPNAKLYIMDYNLDSASYPKTQAIVNRVKQWRAAGVPIDGIGSQMHLSAGQGAGVLQALPLLASAGTPEVSILMLDVAGASPTDYVNVVNACLNVQSCVGITVFGVADPDSWRASSTPLLFDGNFNPKPAYNAIVQNLQQGSIEGRGHHHHHH
Non polymer #2 6NT

InChI=1S/C6H4N4O2/c11-10(12)4-1-2-5-6(3-4)8-9-7-5/h1-3H,(H,7,8,9)

c1cc2c(cc1[N+](=O)[O-])[nH]nn2
Non polymer #3 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