2025-10-18_00000227
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ligand
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9JZ9
PfDXR - Mn2+ - MAMK218 ternary complex;
X-ray diffraction 1.33Å
Protein #1
488 residues (84% resolved)
Raw Sequence ...
MKKYIYIYFFFITITINDLVINNTSKCVSIERRKNNAYINYGIGYNGPDNKITKSRRCKRIKLCKKDLIDIGAIKKPINVAIFGSTGSIGTNALNIIRECNKIENVFNVKALYVNKSVNELYEQAREFLPEYLCIHDKSVYEELKELVKNIKDYKPIILCGDEGMKEICSSNSIDKIVIGIDSFQGLYSTMYAIMNNKIVALANKESIVSAGFFLKKLLNIHKNAKIIPVDSEHSAIFQCLDNNKVLKTKCLQDNFSKINNINKIFLCSSGGPFQNLTMDELKNVTSENALKHPKWKMGKKITIDSATMMNKGLEVIETHFLFDVDYNDIEVIVHKECIIHSCVEFIDKSVISQMYYPDMQIPILYSLTWPDRIKTNLKPLDLAQVSTLTFHKPSLEHFPCIKLAYQAGIKGNFYPTVLNASNEIANNLFLNNKIKYFDISSIISQVLESFNSQKVSENSEDLMKQILQIHSWAKDKATDIYNKHNSS
Canonical Sequence ...
MKKYIYIYFFFITITINDLVINNTSKCVSIERRKNNAYINYGIGYNGPDNKITKSRRCKRIKLCKKDLIDIGAIKKPINVAIFGSTGSIGTNALNIIRECNKIENVFNVKALYVNKSVNELYEQAREFLPEYLCIHDKSVYEELKELVKNIKDYKPIILCGDEGMKEICSSNSIDKIVIGIDSFQGLYSTMYAIMNNKIVALANKESIVSAGFFLKKLLNIHKNAKIIPVDSEHSAIFQCLDNNKVLKTKCLQDNFSKINNINKIFLCSSGGPFQNLTMDELKNVTSENALKHPKWKMGKKITIDSATMMNKGLEVIETHFLFDVDYNDIEVIVHKECIIHSCVEFIDKSVISQMYYPDMQIPILYSLTWPDRIKTNLKPLDLAQVSTLTFHKPSLEHFPCIKLAYQAGIKGNFYPTVLNASNEIANNLFLNNKIKYFDISSIISQVLESFNSQKVSENSEDLMKQILQIHSWAKDKATDIYNKHNSS
Non polymer #2
A1L41
InChI=1S/C20H26NO5P/c22-20(21(23)16-8-7-11-17-9-3-1-4-10-17)15-14-19(27(24,25)26)18-12-5-2-6-13-18/h1-6,9-10,12-13,19,23H,7-8,11,14-16H2,(H2,24,25,26)/t19-/m0/s1
InChI=1S/C20H26NO5P/c22-20(21(23)16-8-7-11-17-9-3-1-4-10-17)15-14-19(27(24,25)26)18-12-5-2-6-13-18/h1-6,9-10,12-13,19,23H,7-8,11,14-16H2,(H2,24,25,26)/t19-/m0/s1
SMILES: c1ccc(cc1)CCCCN(C(=O)CC[C@@H](c2ccccc2)P(=O)(O)O)O
c1ccc(cc1)CCCCN(C(=O)CC[C@@H](c2ccccc2)P(=O)(O)O)O
Non polymer #3
CA
InChI=1S/Ca/q+2
InChI=1S/Ca/q+2
SMILES: [Ca+2]
[Ca+2]
Non polymer #4
MN
InChI=1S/Mn/q+2
InChI=1S/Mn/q+2
SMILES: [Mn+2]
[Mn+2]
Biounit #1
homo-dimer
Download coordinates
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Model
Reference
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