Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000001570 (Bacillus subtilis - May 2016)

Download : Data.csv | 3D Models


Tab legend :
    Full name of ligand selected in the comparative docking column:

    General color information : Quality: [ Good | Correct | Uncertain ]
QueryStructural Alignment (SA)3D Modeling AnnotationLigands from PDB templatesPredicted Complexes - pKd:[ ‹nMol | ‹μMol | ‹mMol ]




 Query Sequence
Filter: 		Significants
SA found		 Seq Ident. 3D Core
(QMean Score)		 Classification code

 Binding Site Ligands Found
(Procognate)		 Profile Complexes by comparative docking
(ligands from PDB templates)

 Targets
for screening


Sort by entries

 [Nb of SA]
 [Best Ident]
 [Best Score]
 Main Code
 [Name]
 [Number]
 [Number]
 Distribution of CDocking pKd
 [Number]
300bsu1088020 33% 0.542 PF00155 C2_S147 - (25)8 1 / 4 / 7 4
301bsu3315023 99% 0.568 PF01923 C5_S131 - (0)8 - / - / 13 3
302bsu3327036 51% 0.588 PF08402 C1_S118 - (0)8 - / 12 / 2 4
303bsu3038030 39% 0.488 PF00005 C1_S116 - (0)8 - / 7 / 3 3
304bsu1483026 61% 0.588 PF04960 C6_S132 - (15)8 - / - / 12 2
305bsu3464019 100% 0.586 PF03641 C3_S127 - (7)8 - / - / 6 3
306bsu3804025 33% 0.494 PF00251 C2_S142 - (19)8 - / - / 7 3
307bsu3155038 34% 0.383 PF00005 C5_S138 - (0)8 - / - / 20 5
308bsu1598030 56% 0.600 PF02978 C8_S125 - (0)8 - / 3 / 5 3
309bsu1221056 100% 0.569 PF00067 C6_S1117 - (0)8 41 / - / 5 1
310bsu0449025 42% 0.416 PF00005 C1_S128 - (0)8 - / 1 / 10 4
311bsu3344073 46% 0.544 PF00175 C2_S1106 - (90)8 37 / 15 / 1 4
312bsu1863019 100% 0.659 PF03330 C3_S120 - (0)8 - / 2 / 8 4
313bsu4040018 100% 0.563 PF00512 C3_S140 - (25)8 3 / 9 / 1 4
314bsu2681048 36% 0.578 PF01177 C5_S153 - (37)8 - / 1 / 33 3
315bsu3986025 39% 0.533 PF00171 C3_S118 - (7)8 - / 1 / 6 4
316bsu0464031 56% 0.594 PF01168 C1_S141 - (27)8 - / 4 / 18 3
317bsu3175020 61% 0.533 PF04095 C6_S128 - (5)8 - / - / 5 3
318bsu2446033 65% 0.569 PF00557 C1_S120 - (1)8 - / 1 / 7 0
319bsu3907027 99% 0.547 PF00722 C2_S148 - (20)8 - / 4 / 3 1
320bsu3592030 42% 0.578 PF00294 C1_S169 - (56)8 - / 1 / 28 3
321bsu3055033 71% 0.513 PF00438 C6_S114 - (9)8 - / - / 8 0
322bsu3660032 40% 0.542 PF00145 C4_S1108 - (35)7 1 / 30 / 4 1
323bsu3381020 100% 0.491 PF04069 C2_S127 - (0)7 - / - / 6 3
324bsu2385020 45% 0.554 PF00479 C1_S115 - (13)7 1 / 1 / 7 3
325bsu0660025 100% 0.692 PF01884 C2_S127 - (0)7 - / 2 / 6 3
326bsu1643021 55% 0.538 PF07194 C1_S117 - (0)7 - / - / 16 4
327bsu3760023 49% 0.487 PF07647 C3_S114 - (0)7 - / 1 / 4 3
328bsu2245031 44% 0.558 PF12627 C4_S122 - (15)7 - / - / 16 3
329bsu3933020 100% 0.697 PF04616 C1_S132 - (0)7 - / - / 8 2
330bsu2378031 36% 0.555 PF00106 C1_S1113 - (74)7 3 / 2 / 10 2
331bsu3412020 80% 0.602 PF07745 C6_S135 - (1)7 - / 1 / 12 3
332bsu4000026 36% 0.600 PF00106 C2_S199 - (71)7 4 / - / 8 3
333bsu2260028 68% 0.574 PF00275 C7_S119 - (13)7 2 / 2 / 6 4
334bsu2485021 46% 0.544 PF00480 C1_S127 - (23)7 - / - / 4 2
335bsu0007048 100% 0.542 PF00521 C8_S193 - (0)7 - / 1 / 35 0
336bsu2357032 73% 0.563 PF00206 C3_S116 - (10)7 - / - / 10 3
337bsu3445024 100% 0.817 PF02435 C4_S133 - (11)7 - / - / 4 3
338bsu3140028 48% 0.665 PF00155 C1_S141 - (29)7 - / 1 / 18 3
339bsu0209027 100% 0.517 PF00905 C3_S162 - (0)7 - / - / 7 3
340bsu0094020 47% 0.508 PF01406 C3_S130 - (3)7 - / - / 7 2
341bsu3304022 64% 0.520 PF00206 C4_S116 - (10)7 - / - / 7 2
342bsu1841048 100% 0.612 PF01019 C3_S143 - (24)7 - / - / 22 5
343bsu2914026 49% 0.598 PF00285 C7_S117 - (13)7 - / 6 / 7 3
344bsu0249030 77% 0.636 PF13378 C1_S115 - (6)7 - / - / 9 2
345bsu3850022 100% 0.559 PF13193 C2_S126 - (16)7 - / 8 / 2 4
346bsu0434022 38% 0.475 PF02776 C7_S191 - (67)7 - / 2 / 3 3
347bsu3717037 57% 0.452 PF02771 C1_S135 - (35)7 7 / 11 / 5 3
348bsu0749030 34% 0.418 PF00005 C1_S119 - (0)7 - / 1 / 10 4
349bsu3354023 56% 0.578 PF02525 C1_S1168 - (89)7 - / 10 / 2 2
350bsu3247023 47% 0.643 PF01799 C5_S134 - (20)7 - / - / 7 0

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