Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000001741 (2017 - Acinetobacter Baumannii - ACIBS: Acinetobacter baumannii (strain SDF) [509170])

Download : Data.csv | 3D Common Core | 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]
350B0VRD919 37% ? PF00512 C2_S133 - (31)5 - / 4 / 1 0
351B0VQR121 45% 0.62 PF00042 C3_S171 - (10)5 1 / 2 / 4 0
352B0VTR819 53% 0.54 PF01479 C4_S120 - (0)5 - / - / 4 0
353B0VTL415 37% 0.48 PF01063 C4_S149 - (41)5 - / - / 8 2
354B0VNX023 35% 0.48 PF02771 C2_S140 - (36)5 2 / 1 / 2 2
355B0VU4037 44% 0.56 PF00175 C1_S1113 - (91)5 21 / 5 / 2 1
356B0VTY020 98% 0.67 PF08543 C4_S133 - (23)5 - / - / 4 1
357B0VTR120 53% 0.65 PF00254 C8_S134 - (0)5 - / 3 / - 1
358B0VUZ410 57% 0.43 PF00293 C1_S1109 - (61)5 - / - / 3 0
359B0VM6920 41% 0.49 PF00149 C3_S124 - (0)5 1 / 1 / 3 1
360B0VQE621 70% 0.57 PF03466 C1_S114 - (0)5 - / - / 8 2
361B0VM8120 56% 0.57 PF00465 C4_S138 - (33)5 - / 6 / - 2
362B0VQD519 65% 0.56 PF03070 C2_S136 - (10)5 - / 8 / 5 2
363B0VTA57 30% 0.27 PF04055 C5_S158 - (4)5 - / - / 4 1
364B0VLL920 40% 0.54 PF05853 C5_S120 - (2)5 - / - / 4 0
365B0VUU233 42% 0.55 PF00196 C2_S147 - (0)5 3 / 8 / 12 2
366B0VQX820 35% 0.49 PF10637 C3_S132 - (0)5 - / 1 / 3 1
367B0VVC931 43% 0.44 PF00145 C4_S1125 - (38)5 2 / 26 / 5 0
368B0VLA418 31% 0.33 PF00710 C2_S126 - (14)5 - / - / 2 0
369B0VQD822 43% 0.56 PF01244 C2_S113 - (0)5 - / - / 4 1
370B0VMN920 99% 0.52 PF01323 C2_S133 - (0)5 - / - / 2 0
371B0VQN820 33% 0.51 PF01979 C2_S121 - (11)5 - / 2 / 6 3
372B0VRY319 62% 0.50 PF01546 C1_S119 - (3)5 - / - / 3 1
373B0VRI722 52% 0.55 PF00108 C6_S112 - (3)5 - / - / 1 0
374B0VPN118 36% 0.47 PF05175 C1_S124 - (0)5 - / - / 3 0
375B0VML622 54% 0.51 PF03702 C2_S144 - (25)5 - / 2 / 4 1
376B0VU0415 47% 0.47 PF02463 C2_S124 - (0)5 - / 6 / - 1
377B0VRV320 46% 0.37 PF06827 C8_S1168 - (0)5 - / 6 / 1 0
378B0VMR611 28% 0.37 PF07922 C6_S122 - (0)5 - / - / 4 0
379B0VM4016 35% 0.52 PF00512 C1_S142 - (38)5 - / 2 / 3 0
380B0VMN618 55% 0.61 PF00106 C1_S167 - (36)5 3 / - / 4 1
381B0VV5520 44% 0.55 PF02771 C3_S145 - (41)5 - / 6 / - 2
382B0VSR720 44% 0.52 PF00884 C2_S117 - (0)5 - / - / 4 0
383B0VUY925 46% 0.48 PF00437 C3_S114 - (13)5 - / 2 / 6 3
384B0VKJ520 37% 0.52 PF13193 C4_S154 - (22)5 - / 1 / 4 0
385B0VUQ017 43% 0.59 PF08282 C1_S132 - (0)5 - / - / 6 0
386B0VUA927 40% 0.51 PF02776 C7_S139 - (19)5 - / 8 / 1 2
387B0VMR120 41% 0.45 PF00793 C6_S115 - (6)5 - / 1 / 3 1
388B0VQA218 62% 0.56 PF02091 C1_S118 - (13)5 - / 1 / 3 1
389B0VMV320 51% 0.63 PF07977 C6_S148 - (1)5 - / - / 5 0
390B0VQK119 55% 0.63 PF02617 C1_S19 - (0)5 - / - / 5 1
391B0VMH122 48% 0.40 PF00909 C2_S117 - (0)5 - / - / 3 1
392B0VPV34 41% 0.51 PF07883 C8_S17 - (0)5 - / - / 3 1
393B0VLJ224 82% 0.57 PF03466 C2_S115 - (0)5 - / - / 9 2
394B0VPU323 46% 0.60 -C2_S121 - (4)5 - / - / 1 0
395B0VR8720 65% 0.58 PF00155 C1_S133 - (28)5 - / 1 / 3 1
396B0VL2822 49% 0.55 PF13840 C2_S122 - (5)5 - / 2 / 5 2
397B0VM5818 38% 0.49 PF01479 C7_S113 - (0)5 - / - / 1 1
398B0VLJ421 57% 0.43 PF00403 C1_S113 - (0)5 - / 4 / 2 2
399B0VMY117 48% 0.54 PF13614 C2_S142 - (0)5 - / 6 / 4 3
400B0VMP820 51% 0.51 PF01510 C1_S124 - (0)5 - / - / 4 2

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