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]
250B0VKN824 65% 0.56 PF03144 C2_S118 - (0)3 - / 8 / 2 2
251B0VNZ920 49% 0.56 PF03033 C4_S126 - (16)5 - / 3 / 2 2
252B0VU2710 48% 0.55 PF00142 C2_S178 - (76)4 - / 4 / - 2
253B0VM3120 52% 0.47 PF13193 C1_S157 - (25)9 - / 7 / 2 2
254B0VT2420 47% 0.58 PF01336 C8_S133 - (23)8 1 / 6 / 1 2
255B0VKT733 45% 0.64 PF01081 C1_S129 - (28)4 - / - / 8 2
256B0VPI827 55% 0.58 PF00793 C4_S118 - (18)6 - / - / 7 2
257B0VLQ112 46% 0.44 PF00571 C1_S147 - (0)4 - / 1 / 6 2
258B0VL8917 67% 0.47 PF01396 C1_S110 - (0)6 2 / - / 4 2
259B0VM8120 56% 0.57 PF00465 C4_S138 - (33)5 - / 6 / - 2
260B0VM6420 52% 0.61 PF01715 C4_S127 - (7)9 - / - / 7 2
261B0VV5520 44% 0.55 PF02771 C3_S145 - (41)5 - / 6 / - 2
262B0VLM041 54% 0.53 PF00490 C7_S144 - (18)19 - / 1 / 24 2
263B0VNZ820 68% 0.61 PF08245 C1_S152 - (27)7 4 / 6 / - 2
264B0VTF717 41% 0.53 PF03588 C8_S123 - (0)10 - / 2 / 8 2
265B0VQP423 50% 0.43 PF01926 C2_S169 - (0)6 5 / 10 / 4 2
266B0VPJ623 45% 0.51 PF08402 C3_S115 - (0)6 - / 8 / 1 2
267B0VM2937 61% 0.64 PF00106 C1_S190 - (70)10 19 / 1 / 4 2
268B0VP3912 38% 0.45 PF04262 C4_S122 - (13)3 - / - / 7 2
269B0VTP629 41% 0.51 PF00044 C7_S137 - (34)4 10 / 13 / - 2
270B0VRW915 67% 0.53 PF00587 C1_S141 - (30)6 4 / 3 / 2 2
271B0VRC723 71% 0.54 PF01336 C7_S135 - (22)7 - / 5 / 8 2
272B0VRB558 71% 0.48 PF01063 C7_S187 - (80)20 - / 16 / 34 2
273B0VQB78 57% 0.58 PF00925 C4_S120 - (9)4 - / 2 / 5 2
274B0VM6318 53% 0.49 PF08676 C2_S125 - (0)3 8 / 1 / - 2
275B0VUW820 38% 0.53 PF13406 C4_S143 - (0)12 - / - / 7 2
276B0VSL420 57% 0.56 PF00579 C4_S138 - (31)9 - / - / 8 2
277B0VSK229 69% 0.56 PF00285 C8_S119 - (15)6 - / 3 / 7 2
278B0VMN118 47% 0.56 PF09084 C1_S132 - (2)3 - / - / 2 1
279B0VU4037 44% 0.56 PF00175 C1_S1113 - (91)5 21 / 5 / 2 1
280B0VLX421 63% 0.57 PF02737 C2_S138 - (36)7 4 / 1 / 3 1
281B0VM6920 41% 0.49 PF00149 C3_S124 - (0)5 1 / 1 / 3 1
282B0VR6520 48% 0.52 PF00296 C4_S118 - (9)2 - / 1 / 2 1
283B0VTQ620 46% 0.62 PF01180 C3_S182 - (43)2 5 / 5 / - 1
284B0VUR721 52% 0.42 PF01799 C7_S115 - (1)3 - / - / 1 1
285B0VUF813 33% 0.42 PF02230 C3_S116 - (1)6 - / - / 6 1
286B0VT2320 42% 0.55 PF01842 C4_S134 - (27)2 4 / 1 / - 1
287B0VKQ820 82% 0.56 PF01926 C3_S137 - (0)3 - / 4 / - 1
288B0VUQ616 36% 0.39 PF04445 C1_S131 - (13)3 - / - / 3 1
289B0VSK544 52% 0.54 PF02910 C1_S151 - (45)6 29 / 1 / 2 1
290B0VSR220 99% 0.64 PF00561 C1_S133 - (12)1 2 / - / - 1
291B0VNI120 68% 0.54 PF02540 C1_S112 - (9)1 - / - / 2 1
292B0VTY423 53% 0.59 PF00698 C1_S118 - (9)9 - / - / 5 1
293B0VPV219 90% 0.63 PF01175 C5_S121 - (21)2 9 / - / - 1
294B0VSE720 43% 0.56 PF02852 C1_S195 - (66)4 4 / - / 1 1
295B0VV7486 56% 0.52 PF00476 C3_S1298 - (176)20 45 / 36 / 11 1
296B0VMR120 41% 0.45 PF00793 C6_S115 - (6)5 - / 1 / 3 1
297B0VTA57 30% 0.27 PF04055 C5_S158 - (4)5 - / - / 4 1
298B0VU9120 36% 0.57 PF02581 C3_S154 - (42)6 - / - / 7 1
299B0VP5723 58% 0.57 PF02580 C11_S130 - (0)12 - / 2 / 5 1
300B0VPA723 66% 0.68 PF00977 C2_S145 - (4)9 - / - / 5 1

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