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. 2020 May 27;21(11):3803. doi: 10.3390/ijms21113803

Table 4.

Residues with significant changes in average L (2 standard deviations away). Residues at the active site are shown in green, residues at the ATP binding site in purple and residues at the Z-domain in magenta.

Protein-Ligand Complex Residues with Significant Decrease in Average L
in the Orthosteric Ligand Complexes
Residues with Significant Increase in Average L
in the Orthosteric Ligand Complexes
PfProRS-SANC152 333, 260, 335, 363, 362, 310, 552, 308, 307, 334, 303, 386, 338, 311, 300, 309 705, 707, 706, 708, 281, 319, 699, 700, 573, 553, 349
PfProRS-SANC235 552, 709, 338, 334, 335, 333, 327, 386, 337, 363, 362, 546, 336, 339 706, 707, 705, 579, 703, 700
PfProRS-SANC236 552, 338, 333, 701, 339, 334, 335, 336, 337, 395, 709, 711, 332, 710, 393, 394 703,705, 707, 704, 706, 698, 319, 700, 702, 314, 316
PfProRS-SANC244 550, 551, 709, 552, 401, 711, 546 707, 706, 703, 705, 349, 702, 368, 347, 700, 704
PfProRS-SANC318 552, 709, 395, 260, 701, 396, 551, 393, 401, 338, 394, 259, 402, 339 705, 707, 703, 328, 704, 319, 316, 281, 702
Protein-
Ligand Complex
Residues with Significant Decrease in Average L in the Allosteric Ligand Complexes Residues with Significant Increase in Average L in the Allosteric Ligand Complexes
PfProRS-SANC184 333, 349, 335, 334, 345, 347, 338, 348, 343, 350, 310, 344, 455, 337, 336, 456, 363, 331, 346, 330, 311 704, 701, 705, 702, 703, 707, 553, 700, 708, 264, 550
PfProRS-SANC257 333, 455, 334, 456, 738, 332, 460, 457, 308 701, 702, 705, 708, 706, 704, 703, 709, 553, 552, 707,396, 700, 550
PfProRS-SANC264 349, 347, 348, 346, 455, 345, 260, 572, 571, 570 704, 705, 708, 702, 703, 709, 701, 328, 553, 327, 330, 331, 707, 706, 552, 264, 265
PfProRS-SANC456 260, 333, 334, 335, 328, 455, 485, 570 701, 708, 705, 702, 707, 706, 704, 709, 396, 316, 703, 553, 319, 550, 264, 265, 268, 700
PfProRS-SANC622 260, 455, 310, 308, 254, 311, 486, 460 701, 702, 704, 706, 707, 703, 341, 708, 339, 319, 705, 338, 709, 346, 347, 342, 348, 343, 345, 344