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]
300bsu2357032 73% 0.563 PF00206 C3_S116 - (10)7 - / - / 10 3
301bsu3086024 40% 0.542 PF03721 C3_S124 - (14)4 - / 3 / 3 3
302bsu0300019 100% 0.584 PF04069 C2_S120 - (0)6 - / - / 8 3
303bsu3796027 45% 0.609 PF00171 C4_S128 - (12)9 - / 6 / 4 3
304bsu0735023 48% 0.553 PF00171 C3_S127 - (0)6 1 / - / 3 3
305bsu3038030 39% 0.488 PF00005 C1_S116 - (0)8 - / 7 / 3 3
306bsu2919027 100% 0.813 PF00365 C3_S117 - (4)6 - / - / 11 3
307bsu0745043 48% 0.589 PF00107 C2_S172 - (51)16 25 / 2 / 9 3
308bsu2002035 100% 0.501 PF00692 C7_S164 - (47)6 - / - / 22 3
309bsu0088018 44% 0.644 PF00633 C5_S122 - (0)6 - / 10 / 7 3
310bsu3468026 48% 0.588 PF02826 C1_S161 - (37)9 6 / 3 / 5 3
311bsu2786045 45% 0.548 PF02749 C7_S133 - (22)10 - / - / 17 3
312bsu2385020 45% 0.554 PF00479 C1_S115 - (13)7 1 / 1 / 7 3
313bsu1962024 100% 0.525 PF01079 C8_S115 - (0)6 - / - / 6 3
314bsu0537020 32% 0.597 PF00155 C1_S142 - (23)5 - / 1 / 8 3
315bsu0660025 100% 0.692 PF01884 C2_S127 - (0)7 - / 2 / 6 3
316bsu3623019 46% 0.569 PF03721 C1_S123 - (13)7 1 / 4 / 2 3
317bsu2872020 72% 0.526 PF06964 C5_S122 - (19)8 - / - / 8 3
318bsu3213041 88% 0.640 PF00478 C2_S146 - (28)16 - / 3 / 17 3
319bsu2993020 100% 0.545 PF02922 C1_S117 - (0)6 - / - / 6 3
320bsu1554023 68% 0.542 PF01180 C1_S168 - (39)8 - / 3 / 8 3
321bsu0209027 100% 0.517 PF00905 C3_S162 - (0)7 - / - / 7 3
322bsu3412020 80% 0.602 PF07745 C6_S135 - (1)7 - / 1 / 12 3
323bsu2311021 42% 0.414 PF00512 C3_S118 - (15)5 - / 7 / 2 3
324bsu3085021 51% 0.501 PF00483 C1_S156 - (45)5 - / 9 / 2 3
325bsu2408020 79% 0.618 PF02812 C7_S117 - (0)6 2 / 6 / 3 3
326bsu0038022 67% 0.612 PF01588 C2_S121 - (0)3 3 / 1 / 1 3
327bsu3692030 55% 0.527 PF02502 C9_S150 - (37)15 - / - / 9 3
328bsu4092021 60% 0.502 PF07670 C1_S152 - (0)6 - / 2 / 4 3
329bsu2761028 55% 0.584 PF00156 C3_S149 - (38)8 - / 6 / 13 3
330bsu2473020 42% 0.541 PF00437 C3_S14 - (0)3 - / 1 / 3 3
331bsu2755023 53% 0.562 PF01336 C5_S140 - (25)6 - / 5 / 7 3
332bsu3820021 47% 0.606 PF00288 C2_S141 - (30)5 - / - / 8 3
333bsu1651027 61% 0.630 PF00696 C1_S127 - (17)7 - / 3 / 5 3
334bsu2350024 77% 0.669 PF01676 C4_S112 - (0)6 - / - / 8 3
335bsu3217024 67% 0.581 PF01678 C4_S17 - (3)4 - / - / 4 3
336bsu3717037 57% 0.452 PF02771 C1_S135 - (35)7 7 / 11 / 5 3
337bsu3479043 71% 0.511 PF07992 C3_S1113 - (96)12 6 / 19 / 7 3
338bsu2214025 55% 0.605 PF00106 C1_S1120 - (69)9 3 / 5 / 1 3
339bsu3760023 49% 0.487 PF07647 C3_S114 - (0)7 - / 1 / 4 3
340bsu2910023 40% 0.390 PF00512 C2_S115 - (0)4 2 / 3 / 3 3
341bsu3970019 100% 0.605 PF02894 C1_S139 - (0)9 - / 10 / 3 3
342bsu1172032 100% 0.614 PF00106 C5_S168 - (36)8 17 / 8 / 1 3
343bsu0908026 37% 0.546 PF09383 C1_S118 - (0)5 - / 5 / 4 3
344bsu2245031 44% 0.558 PF12627 C4_S122 - (15)7 - / - / 16 3
345bsu2808019 35% 0.560 PF08245 C1_S130 - (15)5 - / - / 6 3
346bsu3782023 48% 0.584 PF04321 C1_S160 - (56)4 7 / 1 / - 3
347bsu0092024 43% 0.577 PF00749 C5_S117 - (14)5 - / 5 / 3 3
348bsu1396027 42% 0.570 PF03446 C1_S128 - (15)5 4 / 1 / 2 3
349bsu2283020 44% 0.643 PF01210 C1_S138 - (29)5 4 / 1 / 1 3
350bsu2237030 46% 0.629 PF00155 C1_S139 - (30)7 - / 1 / 22 3

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