2025-10-18_00000229
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ligand
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9JZB
PfDXR - Mn2+ - MAMK251 ternary complex;
X-ray diffraction 1.47Å
Protein #1
488 residues (84% resolved)
Raw Sequence ...
MKKYIYIYFFFITITINDLVINNTSKCVSIERRKNNAYINYGIGYNGPDNKITKSRRCKRIKLCKKDLIDIGAIKKPINVAIFGSTGSIGTNALNIIRECNKIENVFNVKALYVNKSVNELYEQAREFLPEYLCIHDKSVYEELKELVKNIKDYKPIILCGDEGMKEICSSNSIDKIVIGIDSFQGLYSTMYAIMNNKIVALANKESIVSAGFFLKKLLNIHKNAKIIPVDSEHSAIFQCLDNNKVLKTKCLQDNFSKINNINKIFLCSSGGPFQNLTMDELKNVTSENALKHPKWKMGKKITIDSATMMNKGLEVIETHFLFDVDYNDIEVIVHKECIIHSCVEFIDKSVISQMYYPDMQIPILYSLTWPDRIKTNLKPLDLAQVSTLTFHKPSLEHFPCIKLAYQAGIKGNFYPTVLNASNEIANNLFLNNKIKYFDISSIISQVLESFNSQKVSENSEDLMKQILQIHSWAKDKATDIYNKHNSS
Canonical Sequence ...
MKKYIYIYFFFITITINDLVINNTSKCVSIERRKNNAYINYGIGYNGPDNKITKSRRCKRIKLCKKDLIDIGAIKKPINVAIFGSTGSIGTNALNIIRECNKIENVFNVKALYVNKSVNELYEQAREFLPEYLCIHDKSVYEELKELVKNIKDYKPIILCGDEGMKEICSSNSIDKIVIGIDSFQGLYSTMYAIMNNKIVALANKESIVSAGFFLKKLLNIHKNAKIIPVDSEHSAIFQCLDNNKVLKTKCLQDNFSKINNINKIFLCSSGGPFQNLTMDELKNVTSENALKHPKWKMGKKITIDSATMMNKGLEVIETHFLFDVDYNDIEVIVHKECIIHSCVEFIDKSVISQMYYPDMQIPILYSLTWPDRIKTNLKPLDLAQVSTLTFHKPSLEHFPCIKLAYQAGIKGNFYPTVLNASNEIANNLFLNNKIKYFDISSIISQVLESFNSQKVSENSEDLMKQILQIHSWAKDKATDIYNKHNSS
Non polymer #2
A1L43
InChI=1S/C21H28NO5P/c23-21(16-15-20(28(25,26)27)19-13-7-2-8-14-19)22(24)17-9-3-6-12-18-10-4-1-5-11-18/h1-2,4-5,7-8,10-11,13-14,20,24H,3,6,9,12,15-17H2,(H2,25,26,27)/t20-/m0/s1
InChI=1S/C21H28NO5P/c23-21(16-15-20(28(25,26)27)19-13-7-2-8-14-19)22(24)17-9-3-6-12-18-10-4-1-5-11-18/h1-2,4-5,7-8,10-11,13-14,20,24H,3,6,9,12,15-17H2,(H2,25,26,27)/t20-/m0/s1
SMILES: c1ccc(cc1)CCCCCN(C(=O)CC[C@@H](c2ccccc2)P(=O)(O)O)O
c1ccc(cc1)CCCCCN(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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