2024-11-23_00000111|medium|8JE5

Crystal Structure of Anopheles culicifacies Prolyl-tRNA Synthetase (AcPRS) in complex with Halofuginone; X-ray diffraction 2.57Å
Protein #1 505 residues (97% resolved)

MTRLGLEATKEDNLPDWYSQVITKGEMIEYYDVSGCYILRHWSFAIWKAIRNWFDAEITRLGVKECYFPIFVSRAALEREKTHIADFAPEVAWVTKSGDSELAEPIAVRPTSETVMYPAYAKWIQSYRDLPIRLNQWNNVVRWEFKHPQPFLRTREFLWQEGHTAFATQKEADEEVLTILDLYAKVYTDLLAIPVVKGRKTEKEKFAGGDYTTTVEAYISASGRAIQGATSHHLGQNFSRMFDIVYEHPETKEKEYVFQNSWGITTRTIGVMIMVHADNQGLVLPPRVACIQVVIVPCGITATTTDDERRRLYESCRELEQTFVKAGIRCEGDYRDNYSPGWKYNHWELKGVPVRIELGFKDLQNDQFVAVRRDNGAKQTIKRAQATVEMPKLLETIHTSMYERAERDLQSHTKLTKQWAEFLQFLETKNIIMAPFCGEISCEDRIKAESARDDAEAEAGAPAMGAKSLCIPFEQPAKIDPKVDKCVHPACGRVAKFYTLFGRSY

MTRLGLEATKEDNLPDWYSQVITKGEMIEYYDVSGCYILRHWSFAIWKAIRNWFDAEITRLGVKECYFPIFVSRAALEREKTHIADFAPEVAWVTKSGDSELAEPIAVRPTSETVMYPAYAKWIQSYRDLPIRLNQWNNVVRWEFKHPQPFLRTREFLWQEGHTAFATQKEADEEVLTILDLYAKVYTDLLAIPVVKGRKTEKEKFAGGDYTTTVEAYISASGRAIQGATSHHLGQNFSRMFDIVYEHPETKEKEYVFQNSWGITTRTIGVMIMVHADNQGLVLPPRVACIQVVIVPCGITATTTDDERRRLYESCRELEQTFVKAGIRCEGDYRDNYSPGWKYNHWELKGVPVRIELGFKDLQNDQFVAVRRDNGAKQTIKRAQATVEMPKLLETIHTSMYERAERDLQSHTKLTKQWAEFLQFLETKNIIMAPFCGEISCEDRIKAESARDDAEAEAGAPAMGAKSLCIPFEQPAKIDPKVDKCVHPACGRVAKFYTLFGRSY
Non polymer #2 CL

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

[Cl-]
Non polymer #3 HFG

InChI=1S/C16H17BrClN3O3/c17-11-6-13-10(5-12(11)18)16(24)21(8-20-13)7-9(22)4-14-15(23)2-1-3-19-14/h5-6,8,14-15,19,23H,1-4,7H2/t14-,15+/m1/s1

c1c2c(cc(c1Cl)Br)N=CN(C2=O)CC(=O)C[C@@H]3[C@H](CCCN3)O
Non polymer #4 ZN

InChI=1S/Zn/q+2

[Zn+2]
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Reference