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]
300bsu0865021 100% 0.616 PF00106 C1_S1154 - (79)3 4 / - / - 1
301bsu2277066 100% 0.809 PF02081 C16_S192 - (0)2 - / 3 / 47 1
302bsu0051023 100% 0.595 PF13793 C7_S115 - (12)5 - / - / 8 3
303bsu0687020 100% 0.582 PF12680 51 - (6)2 - / - / - 0
304bsu0012021 100% 0.614 PF01174 32 - (0)1 - / - / - 0
305bsu2882020 100% 0.551 PF02127 1 - (0)? - / - / - 0
306bsu0501018 100% 0.607 PF07719 11 - (0)? - / - / - 0
307bsu0048036 100% 0.623 PF01042 C6_S122 - (0)5 - / - / 7 0
308bsu3034059 100% 0.669 PF13426 C2_S177 - (0)3 20 / 18 / 7 2
309bsu4055021 100% 0.638 PF02833 C1_S111 - (0)4 - / - / 7 1
310bsu1660020 100% 0.460 PF00575 0 - (0)? - / - / - 0
311bsu0243028 100% 0.611 PF04960 C6_S121 - (15)8 - / - / 8 3
312bsu1739021 100% 0.574 PF00268 C7_S12 - (0)2 - / - / 1 1
313bsu1578020 100% 0.554 PF03193 C3_S120 - (0)2 - / 8 / - 1
314bsu2235016 100% 0.790 PF07261 0 - (0)? - / - / - 0
315bsu1324015 100% 0.618 PF01910 C4_S12 - (0)1 - / - / 1 1
316bsu2382032 100% 0.686 PF00724 C2_S1178 - (105)10 2 / 8 / 10 3
317bsu0037013 100% 0.520 PF04014 C1_S13 - (0)? - / - / 1 0
318bsu3455027 100% 0.673 PF13419 C1_S122 - (11)13 - / 5 / 12 8
319bsu1423014 100% 0.737 PF00085 20 - (0)? - / - / - 0
320bsu3371019 100% 0.501 PF04069 C4_S125 - (0)7 - / - / 2 1
321bsu1185011 100% 0.612 PF02834 1 - (0)? - / - / - 0
322bsu3750043 100% 0.775 PF00891 C1_S194 - (52)19 4 / 27 / 18 7
323bsu0644020 100% 0.581 PF00206 C3_S117 - (6)3 - / - / 4 1
324bsu170206 100% 0.718 PF06133 6 - (6)? - / - / - 0
325bsu1717020 100% 0.653 PF00378 C2_S117 - (0)4 - / - / 11 1
326bsu280007 100% 0.435 PF03775 1 - (0)? - / - / - 0
327bsu0226011 100% 0.590 PF12697 16 - (0)? - / - / - 0
328bsu1555021 100% 0.871 PF00215 C2_S139 - (26)10 - / 12 / 2 3
329bsu1919019 100% 0.513 PF07730 C2_S116 - (14)5 - / 7 / 3 3
330bsu2841012 100% 0.849 PF00072 C1_S119 - (0)1 - / - / 1 0
331bsu3802027 100% 0.547 PF08543 C2_S163 - (48)9 - / 3 / 12 2
332bsu1920014 100% 0.607 PF00072 10 - (0)1 - / - / - 0
333bsu0131020 100% 0.598 PF00347 0 - (0)? - / - / - 0
334bsu151203 100% 0.555 PF01442 C6_S16 - (0)1 - / - / 3 1
335bsu0253020 100% 0.608 PF15777 0 - (0)? - / - / - 0
336bsu3852016 100% 0.748 PF00550 3 - (0)? - / - / - 0
337bsu214802 100% 0.407 PF00595 3 - (0)1 - / - / - 0
338bsu146503 100% 0.572 PF00171 1 - (0)? - / - / - 0
339bsu3593029 100% 0.571 PF05025 C3_S128 - (0)6 - / - / 12 1
340bsu4043019 100% 0.590 PF00903 6 - (0)? - / - / - 0
341bsu0128020 100% 0.561 PF00673 0 - (0)? - / - / - 0
342bsu1172032 100% 0.614 PF00106 C5_S168 - (36)8 17 / 8 / 1 3
343bsu1221056 100% 0.569 PF00067 C6_S1117 - (0)8 41 / - / 5 1
344bsu1156020 100% 0.640 PF01152 C5_S188 - (0)3 5 / - / 1 0
345bsu1055020 100% 0.608 PF01041 C1_S157 - (0)5 - / 3 / 5 2
346bsu246004 100% 0.832 PF08671 0 - (0)? - / - / - 0
347bsu0270021 100% 0.798 PF01674 C1_S119 - (6)7 - / - / 9 2
348bsu2402018 100% 0.619 PF13411 C2_S127 - (0)2 - / 1 / 13 0
349bsu127603 100% 0.880 PF12937 13 - (0)? - / - / - 0
350bsu3811019 100% 0.499 PF00881 C3_S172 - (42)2 - / 9 / - 1

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