Screening Results : Docking based on all models from entry : EGFR_HUMAN




Display Selection :
 Study : Show results: Values:




Color code: [ Good | Correct | Uncertain | Dubius ] - pKd: [ ‹nMol | ‹μMol | ‹mMol | ›mMol]

Complex support
[Template (Ident) + Anchor]
Model Quality (QMean)		 Position of Lig. Study FilterMeasure
1 8.4 1.9103905562U154 (100%) + xxx_A_2
QMean=0.474 		P1: (7 Cplx.) RUN0 DOpKi= 6.2
2 10.0 2.0103905345U149 (100%) + xxx_A_2
QMean=0.508 		P1: (3 Cplx.) RUN0 DOpKi= 6.3
3 5.7 1.41039051234FYO (42%) + 0VF_A_2
QMean=0.445 		P1: (8 Cplx.) RUN1 DOpKi= 7.1
4 6.1 1.24LL0_YUNU163 (100%) + xxx_A_2
QMean=0.489 		P1: (9 Cplx.) VALID2 DO-= -
5 7.3 2.11039043093LZB (99%) + ITI_D_12
QMean=0.480 		P1: (4 Cplx.) RUN1 DOpKi= 5.9
6 6.7 1.61039046044I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (7 Cplx.) RUN2 DOpKi= 6.4
7 6.9 2.41039042883BEL (100%) + POX_A_4
QMean=0.459 		P1: (3 Cplx.) RUN1 DOpKi= 6
8 7.9 2.2103904314U172 (100%) + xxx_A_2
QMean=0.489 		P1: (10 Cplx.) RUN0 DOpKi= 6.5
9 9.3 2.2103905068U165 (100%) + xxx_A_2
QMean=0.508 		P1: (10 Cplx.) RUN0 DOpKi= 6.1
10 7.0 1.61039042042R4B (80%) + GW7_A_3
QMean=0.520 		P1: (8 Cplx.) RUN1 ODpKi= 6.1
11 5.8 1.91039051804I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (7 Cplx.) RUN1 DOpKi= 6.9
12 7.7 2.01039054964I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (3 Cplx.) RUN2 DOpKi= 6.6
13 7.7 1.91039047544JR3 (100%) + KJR_A_2
QMean=0.479 		P1: (3 Cplx.) RUN1 DOpKi= 6.6
14 6.7 1.71039055933LZB (99%) + ITI_B_10
QMean=0.501 		P1: (5 Cplx.) RUN0 DOpKi= 6.7
15 6.1 2.41039041891XKK (100%) + FMM_A_4
QMean=0.448 		P1: (5 Cplx.) RUN2 DOpKi= 6.1
16 7.3 2.2103905482U164 (100%) + xxx_A_2
QMean=0.489 		P1: (9 Cplx.) RUN0 DOpKi= 5.8
17 8.0 0.41039046522R4B (80%) + GW7_B_4
QMean=0.516 		P1: (7 Cplx.) RUN0 DOpKi= 7
18 7.4 1.91039050244JRV (100%) + KJV_A_2
QMean=0.473 		P1: (8 Cplx.) RUN0 DOpKi= 6.7
19 7.8 2.01039043133W33 (100%) + W19_A_2
QMean=0.487 		P1: (4 Cplx.) RUN2 DOpKi= 6.1
20 7.8 2.01039043553LZB (99%) + ITI_D_12
QMean=0.480 		P1: (3 Cplx.) RUN2 DOpKi= 6.4
21 6.8 2.11039046383W33 (100%) + W19_A_2
QMean=0.487 		P1: (3 Cplx.) RUN1 DOpKi= 6.6
22 6.5 2.51039046734I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (8 Cplx.) RUN1 DOpKi= 6.6
23 7.9 2.51039044114JQ7 (100%) + KJQ_A_2
QMean=0.485 		P1: (3 Cplx.) RUN2 DOpKi= 7.8
24 7.7 1.01039052152R4B (80%) + GW7_A_3
QMean=0.520 		P1: (5 Cplx.) RUN2 ODpKi= 6.4
25 5.8 1.81039051804I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (12 Cplx.) RUN2 ODpKi= 6.9
26 8.3 1.8103904961U159 (100%) + xxx_A_2
QMean=0.489 		P1: (6 Cplx.) RUN0 DOpKi= 6.8
27 8.0 2.4103904787U170 (100%) + xxx_A_2
QMean=0.489 		P1: (4 Cplx.) RUN0 DOpKi= 6.1
28 8.0 1.41039049612RGP (100%) + HYZ_A_4
QMean=0.507 		P1: (6 Cplx.) RUN2 DOpKi= 6.8
29 7.0 2.31039055324JR3 (100%) + KJR_A_2
QMean=0.479 		P1: (6 Cplx.) RUN2 DOpKi= 7.7
30 7.8 1.11039051404JRV (100%) + KJV_A_2
QMean=0.473 		P1: (13 Cplx.) RUN1 DOpKi= 7.7
31 7.4 1.81039056082ITT (99%) + AEE_A_2
QMean=0.438 		P1: (5 Cplx.) RUN0 DOpKi= 6.4
32 9.9 1.21039055661XKK (100%) + FMM_A_4
QMean=0.448 		P1: (3 Cplx.) RUN0 DOpKi= 8.2
33 9.7 1.51039047853POZ (100%) + 03P_A_5
QMean=0.479 		P1: (5 Cplx.) RUN0 DOpKi= 6.3
34 8.4 2.31039047121XKK (100%) + FMM_A_4
QMean=0.448 		P1: (3 Cplx.) RUN2 DOpKi= 6.1
35 6.2 1.91039056414JQ8 (100%) + KJ8_A_2
QMean=0.471 		P1: (15 Cplx.) RUN1 DOpKi= 6.5
36 6.7 2.51039046014I22 (99%) + IRE_A_2
QMean=0.468 		P1: (4 Cplx.) RUN2 DOpKi= 7.5
37 7.1 1.74LQM_DJK4I24 (99%) + 1C9_B_4
QMean=0.462 		P1: (12 Cplx.) VALID0 DO-= -
38 7.7 2.44RJ7_3R1U159 (100%) + xxx_A_2
QMean=0.489 		P1: (6 Cplx.) VALID2 DO-= -
39 8.5 2.11039047251XKK (100%) + FMM_A_4
QMean=0.448 		P1: (3 Cplx.) RUN2 DOpKi= 5.9
40 8.8 2.11039053453W33 (100%) + W19_A_2
QMean=0.487 		P1: (3 Cplx.) RUN1 DOpKi= 6.3
41 6.9 1.41039042134I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (7 Cplx.) RUN1 DOpKi= 5.7
42 6.9 1.31039042113BEL (100%) + POX_A_4
QMean=0.459 		P1: (7 Cplx.) RUN1 DOpKi= 6
43 7.7 2.31039053163W33 (100%) + W19_A_2
QMean=0.487 		P1: (3 Cplx.) RUN1 DOpKi= 7.6
44 7.1 1.81039048193POZ (100%) + 03P_A_5
QMean=0.479 		P1: (15 Cplx.) RUN2 DOpKi= 6.6
45 5.7 1.61039054241M17 (100%) + AQ4_A_2
QMean=0.462 		P1: (6 Cplx.) RUN1 DOpKi= 7.3
46 9.1 1.81039047543LZB (99%) + ITI_D_12
QMean=0.480 		P1: (4 Cplx.) RUN2 DOpKi= 6.6
47 6.1 2.41039042924FYO (42%) + 0VF_A_2
QMean=0.445 		P1: (3 Cplx.) RUN2 DOpKi= 5.9
48 7.1 2.41039056412R4B (80%) + GW7_A_3
QMean=0.520 		P1: (13 Cplx.) RUN2 DOpKi= 6.5
49 9.9 1.51039044202RGP (100%) + HYZ_A_4
QMean=0.507 		P1: (4 Cplx.) RUN2 DOpKi= 8.4
50 6.9 1.61039042162R4B (80%) + GW7_A_3
QMean=0.520 		P1: (3 Cplx.) RUN1 ODpKi= 6.2
51 6.7 1.94WKQ_IREU170 (100%) + xxx_A_2
QMean=0.489 		P1: (9 Cplx.) VALID2 DO-= -
52 6.2 2.51039054433PP0 (78%) + 03Q_B_4
QMean=0.457 		P1: (12 Cplx.) RUN1 DOpKi= 6.5
53 7.7 2.21039050674JQ7 (100%) + KJQ_A_2
QMean=0.485 		P1: (4 Cplx.) RUN2 DOpKi= 5.9
54 7.4 1.51039054444JRV (100%) + KJV_A_2
QMean=0.473 		P1: (5 Cplx.) RUN1 DOpKi= 5.8
55 7.5 2.41039054822R4B (80%) + GW7_A_3
QMean=0.520 		P1: (11 Cplx.) RUN2 DOpKi= 5.8
56 8.6 2.5103905445U167 (100%) + xxx_A_2
QMean=0.480 		P1: (7 Cplx.) RUN0 DOpKi= 5.8
57 10.4 0.81039055663PP0 (78%) + 03Q_B_4
QMean=0.457 		P1: (8 Cplx.) RUN2 DOpKi= 8.2
58 9.0 1.21039047792R4B (80%) + GW7_A_3
QMean=0.520 		P1: (6 Cplx.) RUN2 DOpKi= 5.8
59 6.1 1.51039042114G5J (100%) + 0WN_A_2
QMean=0.472 		P1: (11 Cplx.) RUN2 DOpKi= 6
60 8.7 2.4103905444U153 (100%) + xxx_A_2
QMean=0.480 		P1: (8 Cplx.) RUN0 ODpKi= 5.8
61 5.7 2.11039056082RGP (100%) + HYZ_A_4
QMean=0.507 		P1: (9 Cplx.) RUN1 DOpKi= 6.4
62 7.3 1.61039041951XKK (100%) + FMM_A_4
QMean=0.448 		P1: (8 Cplx.) RUN1 DOpKi= 6.4
63 8.4 1.91039054883BEL (100%) + POX_A_4
QMean=0.459 		P1: (4 Cplx.) RUN2 DOpKi= 7.1
64 5.4 0.7103905168U162 (100%) + xxx_A_2
QMean=0.457 		P1: (11 Cplx.) RUN0 DOpKi= 6.5
65 7.9 1.51039041964I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (12 Cplx.) RUN1 DOpKi= 6.6
66 8.1 1.51039041964I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (10 Cplx.) RUN2 DOpKi= 6.6
67 6.7 1.44WKQ_IRE4I22 (99%) + IRE_A_2
QMean=0.468 		P1: (4 Cplx.) VALID0 DO-= -
68 5.9 2.11039050854FYO (42%) + 0VF_A_2
QMean=0.445 		P1: (13 Cplx.) RUN0 DOpKi= 6.5
69 7.0 1.81039056074I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (8 Cplx.) RUN1 DOpKi= 5.8
70 5.6 0.81039050852R4B (80%) + GW7_A_3
QMean=0.520 		P1: (16 Cplx.) RUN1 DOpKi= 6.5
71 8.4 2.3103905496U149 (100%) + xxx_A_2
QMean=0.508 		P1: (5 Cplx.) RUN0 DOpKi= 6.6
72 5.6 1.81039042924FYO (42%) + 0VF_A_2
QMean=0.445 		P1: (3 Cplx.) RUN1 DOpKi= 5.9
73 7.4 1.61039055624JRV (100%) + KJV_A_2
QMean=0.473 		P1: (6 Cplx.) RUN1 DOpKi= 6.2
74 6.2 1.01039051803LZB (99%) + ITI_B_10
QMean=0.501 		P1: (19 Cplx.) RUN0 DOpKi= 6.9
75 9.3 2.01039047843PP0 (78%) + 03Q_B_4
QMean=0.457 		P1: (5 Cplx.) RUN1 DOpKi= 6.7
76 5.6 0.81039051683PP0 (78%) + 03Q_B_4
QMean=0.457 		P1: (15 Cplx.) RUN1 DOpKi= 6.5
77 5.4 0.91039050852R4B (80%) + GW7_A_3
QMean=0.520 		P1: (15 Cplx.) RUN2 DOpKi= 6.5
78 7.6 1.11039051404JQ8 (100%) + KJ8_A_2
QMean=0.471 		P1: (10 Cplx.) RUN2 DOpKi= 7.7
79 7.7 0.31039046521XKK (100%) + FMM_A_4
QMean=0.448 		P1: (10 Cplx.) RUN2 DOpKi= 7
80 9.0 2.4103905063U165 (100%) + xxx_A_2
QMean=0.508 		P1: (10 Cplx.) RUN0 DOpKi= 7.2
81 5.9 1.51039050844I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (14 Cplx.) RUN1 DOpKi= 6.8
82 7.7 1.81039055933POZ (100%) + 03P_A_5
QMean=0.479 		P1: (7 Cplx.) RUN1 DOpKi= 6.7
83 8.1 1.51039043214JRV (100%) + KJV_A_2
QMean=0.473 		P1: (8 Cplx.) RUN2 DOpKi= 6.5
84 7.3 1.64RJ5_3QYU158 (100%) + xxx_A_2
QMean=0.489 		P1: (6 Cplx.) VALID2 DO-= -
85 7.9 1.61039050244I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (7 Cplx.) RUN2 ODpKi= 6.7
86 9.6 1.5103904991U156 (100%) + xxx_A_2
QMean=0.468 		P1: (7 Cplx.) RUN0 DOpKi= 7.5
87 7.2 2.11039043094I22 (99%) + IRE_A_2
QMean=0.468 		P1: (4 Cplx.) RUN2 DOpKi= 5.9
88 6.4 2.24RIW_ANP3GT8 (99%) + ANP_C_10
QMean=0.465 		P1: (3 Cplx.) VALID2 OD-= -
89 6.7 1.81039050944I22 (99%) + IRE_A_2
QMean=0.468 		P1: (9 Cplx.) RUN1 DOpKi= 6.6
90 8.4 2.2103905251U158 (100%) + xxx_A_2
QMean=0.489 		P1: (6 Cplx.) RUN0 DOpKi= 5.9
91 6.2 1.51039045944I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (4 Cplx.) RUN1 DOpKi= 6.7
92 6.7 1.44LL0_YUN4I24 (99%) + 1C9_B_4
QMean=0.462 		P1: (8 Cplx.) VALID0 DO-= -
93 6.1 2.1103905424U159 (100%) + xxx_A_2
QMean=0.489 		P1: (8 Cplx.) RUN0 DOpKi= 7.3
94 7.6 1.71039056481XKK (100%) + FMM_A_4
QMean=0.448 		P1: (6 Cplx.) RUN2 DOpKi= 5.8
95 8.1 1.81039047963POZ (100%) + 03P_A_5
QMean=0.479 		P1: (6 Cplx.) RUN1 DOpKi= 6.7
96 6.3 2.21039055324FYO (42%) + 0VF_A_2
QMean=0.445 		P1: (9 Cplx.) RUN1 DOpKi= 7.7
97 7.1 0.91039050244JQ8 (100%) + KJ8_A_2
QMean=0.471 		P1: (5 Cplx.) RUN1 DOpKi= 6.7
98 7.2 1.41039042134I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (8 Cplx.) RUN2 DOpKi= 5.7
99 5.4 1.21039046463W2S (100%) + W2R_A_2
QMean=0.482 		P1: (11 Cplx.) RUN2 DOpKi= 7.3
100 6.9 2.01039044513LZB (99%) + ITI_D_12
QMean=0.480 		P1: (3 Cplx.) RUN1 DOpKi= 6.4
101 8.6 2.41039050642R4B (80%) + GW7_A_3
QMean=0.520 		P1: (6 Cplx.) RUN1 DOpKi= 5.9
102 8.5 2.11039050694JQ8 (100%) + KJ8_A_2
QMean=0.471 		P1: (9 Cplx.) RUN2 DOpKi= 6.1
103 8.5 2.0103905069U153 (100%) + xxx_A_2
QMean=0.480 		P1: (10 Cplx.) RUN0 DOpKi= 6.1
104 5.4 1.01039051683PP0 (78%) + 03Q_B_4
QMean=0.457 		P1: (14 Cplx.) RUN2 DOpKi= 6.5
105 7.8 1.6103904194U160 (100%) + xxx_A_2
QMean=0.489 		P1: (12 Cplx.) RUN0 DOpKi= 6
106 6.6 2.41039046734I24 (99%) + 1C9_B_4
QMean=0.462 		P1: (14 Cplx.) RUN0 DOpKi= 6.6
107 8.3 2.41039050614JRV (100%) + KJV_A_2
QMean=0.473 		P1: (6 Cplx.) RUN1 DOpKi= 7.2
108 6.8 0.91039045504JRV (100%) + KJV_A_2
QMean=0.473 		P1: (7 Cplx.) RUN1 DOpKi= 7.4
109 7.7 2.11039050674JQ7 (100%) + KJQ_A_2
QMean=0.485 		P1: (5 Cplx.) RUN1 DOpKi= 5.9
110 7.5 2.0103904819U173 (100%) + xxx_A_2
QMean=0.489 		P1: (14 Cplx.) RUN0 DOpKi= 6.6
111 6.5 2.21039046734I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (13 Cplx.) RUN2 DOpKi= 6.6
112 7.4 2.21039044024JRV (100%) + KJV_A_2
QMean=0.473 		P1: (4 Cplx.) RUN1 DOpKi= 7.1
113 8.0 1.91039042133LZB (99%) + ITI_C_11
QMean=0.503 		P1: (8 Cplx.) RUN0 DOpKi= 5.7
114 6.8 2.0103904912U165 (100%) + xxx_A_2
QMean=0.508 		P1: (7 Cplx.) RUN0 DOpKi= 6.3
115 8.5 1.61039046034I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (5 Cplx.) RUN2 DOpKi= 6.2
116 6.6 0.81039052154I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (5 Cplx.) RUN1 DOpKi= 6.4
117 8.3 1.8103905215U149 (100%) + xxx_A_2
QMean=0.508 		P1: (6 Cplx.) RUN0 DOpKi= 6.4
118 7.3 1.41039054454JQ7 (100%) + KJQ_A_2
QMean=0.485 		P1: (4 Cplx.) RUN2 DOpKi= 5.8
119 6.5 2.11039050553BEL (100%) + POX_A_4
QMean=0.459 		P1: (8 Cplx.) RUN0 DOpKi= 6.4
120 7.5 1.41039045964I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (3 Cplx.) RUN2 DOpKi= 6.4
121 8.5 2.11039044114JRV (100%) + KJV_A_2
QMean=0.473 		P1: (4 Cplx.) RUN1 DOpKi= 7.8
122 9.4 1.71039047843W2S (100%) + W2R_A_2
QMean=0.482 		P1: (4 Cplx.) RUN0 DOpKi= 6.7
123 7.7 0.31039046522R4B (80%) + GW7_A_3
QMean=0.520 		P1: (10 Cplx.) RUN1 DOpKi= 7
124 7.1 1.8103904783U173 (100%) + xxx_A_2
QMean=0.489 		P1: (11 Cplx.) RUN0 DOpKi= 6.7
125 7.5 1.71039041921XKK (100%) + FMM_A_4
QMean=0.448 		P1: (10 Cplx.) RUN1 DOpKi= 6.7
126 5.8 0.71039046462R4B (80%) + GW7_A_3
QMean=0.520 		P1: (12 Cplx.) RUN1 DOpKi= 7.3
127 7.8 1.31039052511XKK (100%) + FMM_A_4
QMean=0.448 		P1: (7 Cplx.) RUN1 DOpKi= 5.9
128 5.2 0.51039051232R4B (80%) + GW7_A_3
QMean=0.520 		P1: (8 Cplx.) RUN2 DOpKi= 7.1
129 8.8 2.41039050633POZ (100%) + 03P_A_5
QMean=0.479 		P1: (10 Cplx.) RUN2 DOpKi= 7.2
130 6.7 1.61039047834JQ8 (100%) + KJ8_A_2
QMean=0.471 		P1: (14 Cplx.) RUN1 DOpKi= 6.7
131 7.9 2.11039048281XKK (100%) + FMM_A_4
QMean=0.448 		P1: (3 Cplx.) RUN1 DOpKi= 6.7
132 6.7 2.24RIW_ADP3POZ (100%) + 03P_A_5
QMean=0.479 		P1: (4 Cplx.) VALID2 DO-= -
133 8.4 2.5103904313U164 (100%) + xxx_A_2
QMean=0.489 		P1: (10 Cplx.) RUN0 DOpKi= 6.1
134 6.5 2.21039054882R4B (80%) + GW7_A_3
QMean=0.520 		P1: (3 Cplx.) RUN1 DOpKi= 7.1
135 8.5 1.41039049913W32 (100%) + W32_A_2
QMean=0.498 		P1: (10 Cplx.) RUN1 DOpKi= 7.5
136 9.5 2.11039047853PP0 (78%) + 03Q_B_4
QMean=0.457 		P1: (8 Cplx.) RUN1 DOpKi= 6.3
137 7.5 2.11039055314FYO (42%) + 0VF_A_2
QMean=0.445 		P1: (5 Cplx.) RUN2 DOpKi= 7.6
138 9.9 2.2103904754U159 (100%) + xxx_A_2
QMean=0.489 		P1: (6 Cplx.) RUN0 ODpKi= 6.6
139 6.4 1.81039044024JQ8 (100%) + KJ8_A_2
QMean=0.471 		P1: (3 Cplx.) RUN2 ODpKi= 7.1
140 5.9 1.41039050844I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (16 Cplx.) RUN2 DOpKi= 6.8
141 7.2 1.91039050564I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (6 Cplx.) RUN1 DOpKi= 5.9
142 9.2 1.91039053163BEL (100%) + POX_A_4
QMean=0.459 		P1: (5 Cplx.) RUN2 DOpKi= 7.6
143 8.9 2.21039050614I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (5 Cplx.) RUN2 DOpKi= 7.2
144 7.3 1.41039046034I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (3 Cplx.) RUN1 DOpKi= 6.2
145 8.5 2.21039050683POZ (100%) + 03P_A_5
QMean=0.479 		P1: (11 Cplx.) RUN2 DOpKi= 6.1
146 7.8 2.31039042723POZ (100%) + 03P_A_5
QMean=0.479 		P1: (3 Cplx.) RUN1 DOpKi= 6.3
147 6.5 1.81039050554JRV (100%) + KJV_A_2
QMean=0.473 		P1: (7 Cplx.) RUN2 DOpKi= 6.4
148 6.8 1.61039047834I22 (99%) + IRE_A_2
QMean=0.468 		P1: (13 Cplx.) RUN2 DOpKi= 6.7
149 6.0 1.91039054242R4B (80%) + GW7_A_3
QMean=0.520 		P1: (4 Cplx.) RUN2 DOpKi= 7.3
150 9.5 1.01039055663PP0 (78%) + 03Q_B_4
QMean=0.457 		P1: (7 Cplx.) RUN1 DOpKi= 8.2
151 8.8 2.01039044174JRV (100%) + KJV_A_2
QMean=0.473 		P1: (3 Cplx.) RUN2 DOpKi= 7.5
152 6.9 2.31039049653W32 (100%) + W32_A_2
QMean=0.498 		P1: (6 Cplx.) RUN1 DOpKi= 6.2
153 7.1 2.2103905094U153 (100%) + xxx_A_2
QMean=0.480 		P1: (6 Cplx.) RUN0 DOpKi= 6.6
154 6.6 1.51039042142R4B (80%) + GW7_A_3
QMean=0.520 		P1: (15 Cplx.) RUN2 DOpKi= 5.8
155 6.7 1.51039044033LZB (99%) + ITI_C_11
QMean=0.503 		P1: (6 Cplx.) RUN0 DOpKi= 6
156 6.6 0.8103904214U160 (100%) + xxx_A_2
QMean=0.489 		P1: (16 Cplx.) RUN0 DOpKi= 5.8
157 8.6 2.21039052503PP0 (78%) + 03Q_B_4
QMean=0.457 		P1: (7 Cplx.) RUN0 DOpKi= 6.4
158 7.2 2.01039055314JR3 (100%) + KJR_A_2
QMean=0.479 		P1: (10 Cplx.) RUN1 DOpKi= 7.6
159 9.3 2.21039047111XKK (100%) + FMM_A_4
QMean=0.448 		P1: (6 Cplx.) RUN1 DOpKi= 6.3
160 7.1 1.11039041941XKK (100%) + FMM_A_4
QMean=0.448 		P1: (6 Cplx.) RUN2 DOpKi= 6
161 7.4 1.61039041953PP0 (78%) + 03Q_B_4
QMean=0.457 		P1: (10 Cplx.) RUN2 DOpKi= 6.4
162 6.9 2.14RJ8_3QS4I22 (99%) + IRE_A_2
QMean=0.468 		P1: (4 Cplx.) VALID0 DO-= -
163 8.4 1.91039047523POZ (100%) + 03P_A_5
QMean=0.479 		P1: (6 Cplx.) RUN1 DOpKi= 5.8
164 7.7 2.11039046384I24 (99%) + 1C9_B_4
QMean=0.462 		P1: (3 Cplx.) RUN0 DOpKi= 6.6
165 5.9 1.81039049124JQ7 (100%) + KJQ_A_2
QMean=0.485 		P1: (8 Cplx.) RUN1 DOpKi= 6.3
166 6.3 0.94LQM_DJK4I24 (99%) + 1C9_B_4
QMean=0.462 		P1: (12 Cplx.) VALID2 DO-= -
167 7.9 1.51039049611XKK (100%) + FMM_A_4
QMean=0.448 		P1: (8 Cplx.) RUN1 DOpKi= 6.8
168 6.3 2.31039041931XKK (100%) + FMM_A_4
QMean=0.448 		P1: (4 Cplx.) RUN2 DOpKi= 6.1
169 6.6 2.21039045944JQ8 (100%) + KJ8_A_2
QMean=0.471 		P1: (6 Cplx.) RUN2 DOpKi= 6.7
170 6.3 1.01039052591XKK (100%) + FMM_A_4
QMean=0.448 		P1: (5 Cplx.) RUN1 DOpKi= 6.4
171 8.4 2.51039044023W33 (100%) + W19_A_2
QMean=0.487 		P1: (3 Cplx.) RUN0 DOpKi= 7.1
172 8.3 2.34RJ7_3R1U159 (100%) + xxx_A_2
QMean=0.489 		P1: (5 Cplx.) VALID0 DO-= -
173 7.2 2.11039044204JQ8 (100%) + KJ8_A_2
QMean=0.471 		P1: (4 Cplx.) RUN1 DOpKi= 8.4
174 7.3 1.71039056274JR3 (100%) + KJR_A_2
QMean=0.479 		P1: (3 Cplx.) RUN1 DOpKi= 5.8
175 5.5 2.11039046004I24 (99%) + 1C9_A_3
QMean=0.490 		P1: (4 Cplx.) RUN1 DOpKi= 7.2
176 6.0 1.41039050844I24 (99%) + 1C9_B_4
QMean=0.462 		P1: (11 Cplx.) RUN0 DOpKi= 6.8
177 9.9 1.21039047841XKK (100%) + FMM_A_4
QMean=0.448 		P1: (6 Cplx.) RUN2 DOpKi= 6.7
178 5.5 0.4103905123U162 (100%) + xxx_A_2
QMean=0.457 		P1: (6 Cplx.) RUN0 DOpKi= 7.1
179 7.2 2.21039043103W33 (100%) + W19_A_2
QMean=0.487 		P1: (5 Cplx.) RUN2 DOpKi= 5.8
180 8.4 2.11039052514JQ8 (100%) + KJ8_A_2
QMean=0.471 		P1: (6 Cplx.) RUN2 DOpKi= 5.9
181 6.2 2.3103904965U153 (100%) + xxx_A_2
QMean=0.480 		P2: (6 Cplx.) RUN0 DOpKi= 6.2
182 6.8 1.31039055773LZB (99%) + ITI_D_12
QMean=0.480 		P2: (3 Cplx.) RUN1 DOpKi= 5.9
183 7.7 2.2103904309U172 (100%) + xxx_A_2
QMean=0.489 		P2: (5 Cplx.) RUN0 DOpKi= 5.9
184 5.3 2.21039043084JRV (100%) + KJV_A_2
QMean=0.473 		P2: (3 Cplx.) RUN1 DOpKi= 6.3
185 7.2 2.11039043103LZB (99%) + ITI_D_12
QMean=0.480 		P2: (3 Cplx.) RUN1 DOpKi= 5.8
186 6.0 2.31039049654JQ8 (100%) + KJ8_A_2
QMean=0.471 		P2: (4 Cplx.) RUN2 DOpKi= 6.2
187 7.5 2.04RJ5_3QY4FYO (42%) + 0VF_A_2
QMean=0.445 		P2: (6 Cplx.) VALID0 OD-= -
188 8.1 1.61039047873LZB (99%) + ITI_D_12
QMean=0.480 		P2: (3 Cplx.) RUN1 DOpKi= 6.1
189 6.4 2.11039044033BEL (100%) + POX_A_4
QMean=0.459 		P2: (5 Cplx.) RUN2 DOpKi= 6
190 8.3 1.81039047961XKK (100%) + FMM_A_4
QMean=0.448 		P2: (4 Cplx.) RUN2 DOpKi= 6.7
191 9.6 1.71039053452R4B (80%) + GW7_A_3
QMean=0.520 		P2: (3 Cplx.) RUN2 DOpKi= 6.3
192 6.6 1.94RJ8_3QSU160 (100%) + xxx_A_2
QMean=0.489 		P2: (4 Cplx.) VALID2 DO-= -
193 7.0 1.61039045963IKA (99%) + 0UN_A_3
QMean=0.462 		P2: (3 Cplx.) RUN1 DOpKi= 6.4
194 9.9 1.41039047853PP0 (78%) + 03Q_B_4
QMean=0.457 		P2: (3 Cplx.) RUN2 DOpKi= 6.3
195 8.5 2.21039052503PP0 (78%) + 03Q_B_4
QMean=0.457 		P2: (3 Cplx.) RUN2 DOpKi= 6.4
196 6.4 1.11039042014JRV (100%) + KJV_A_2
QMean=0.473 		P2: (5 Cplx.) RUN1 DOpKi= 6.2
197 7.9 1.74RJ6_3R0U160 (100%) + xxx_A_2
QMean=0.489 		P2: (4 Cplx.) VALID2 OD-= -
198 7.7 1.61039045914JQ7 (100%) + KJQ_A_2
QMean=0.485 		P2: (3 Cplx.) RUN2 ODpKi= 7.1
199 6.6 1.61039042044I24 (99%) + 1C9_A_3
QMean=0.490 		P2: (3 Cplx.) RUN2 ODpKi= 6.1
200 5.9 1.31039055402RGP (100%) + HYZ_A_4
QMean=0.507 		P2: (4 Cplx.) RUN2 DOpKi= 7.6
201 7.2 1.21039046004I24 (99%) + 1C9_A_3
QMean=0.490 		P2: (4 Cplx.) RUN2 DOpKi= 7.2
202 7.6 2.4103904288U165 (100%) + xxx_A_2
QMean=0.508 		P2: (4 Cplx.) RUN0 DOpKi= 6
203 6.3 1.51039046383IKA (99%) + 0UN_A_3
QMean=0.462 		P2: (3 Cplx.) RUN2 DOpKi= 6.6
204 8.7 2.01039047963LZB (99%) + ITI_C_11
QMean=0.503 		P2: (3 Cplx.) RUN0 DOpKi= 6.7
205 9.3 2.41039054293PP0 (78%) + 03Q_B_4
QMean=0.457 		P2: (4 Cplx.) RUN1 DOpKi= 6.6
206 8.2 1.61039055624JRV (100%) + KJV_A_2
QMean=0.473 		P2: (3 Cplx.) RUN2 DOpKi= 6.2
207 6.6 2.41039042163LZB (99%) + ITI_D_12
QMean=0.480 		P2: (3 Cplx.) RUN2 DOpKi= 6.2
208 7.6 1.71039056484I24 (99%) + 1C9_A_3
QMean=0.490 		P2: (3 Cplx.) RUN1 DOpKi= 5.8
209 6.6 1.61039055934JRV (100%) + KJV_A_2
QMean=0.473 		P2: (5 Cplx.) RUN2 DOpKi= 6.7
210 7.6 2.51039056324JQ8 (100%) + KJ8_A_2
QMean=0.471 		P2: (3 Cplx.) RUN1 DOpKi= 6.7
211 9.0 2.11039054883PP0 (78%) + 03Q_A_3
QMean=0.500 		P2: (4 Cplx.) RUN0 DOpKi= 7.1
212 5.2 0.6103904646U162 (100%) + xxx_A_2
QMean=0.457 		P2: (4 Cplx.) RUN0 DOpKi= 7.3
213 6.3 1.01039052591XKK (100%) + FMM_A_4
QMean=0.448 		P2: (4 Cplx.) RUN2 DOpKi= 6.4
214 7.1 1.51039050684JQ7 (100%) + KJQ_A_2
QMean=0.485 		P2: (3 Cplx.) RUN1 DOpKi= 6.1
215 6.4 1.91039050554JRV (100%) + KJV_A_2
QMean=0.473 		P2: (6 Cplx.) RUN1 DOpKi= 6.4
216 7.6 2.01039043143LZB (99%) + ITI_D_12
QMean=0.480 		P2: (3 Cplx.) RUN2 DOpKi= 6.5
217 5.7 1.71039046041M17 (100%) + AQ4_A_2
QMean=0.462 		P2: (4 Cplx.) RUN1 DOpKi= 6.4
218 8.3 1.6103904196U160 (100%) + xxx_A_2
QMean=0.489 		P2: (8 Cplx.) RUN0 DOpKi= 6.6
219 7.6 1.4103904600U158 (100%) + xxx_A_2
QMean=0.489 		P2: (3 Cplx.) RUN0 DOpKi= 7.2
220 7.2 2.0103904195U160 (100%) + xxx_A_2
QMean=0.489 		P2: (4 Cplx.) RUN0 DOpKi= 6.4
221 8.4 1.91039047523PP0 (78%) + 03Q_B_4
QMean=0.457 		P2: (3 Cplx.) RUN2 DOpKi= 5.8
222 6.5 1.61039056083IKA (99%) + 0UN_A_3
QMean=0.462 		P2: (3 Cplx.) RUN2 DOpKi= 6.4
223 7.2 1.71039054444JQ7 (100%) + KJQ_A_2
QMean=0.485 		P2: (3 Cplx.) RUN2 DOpKi= 5.8
224 6.5 2.21039050943PP0 (78%) + 03Q_B_4
QMean=0.457 		P2: (6 Cplx.) RUN2 DOpKi= 6.6
225 9.6 2.3103905061U157 (100%) + xxx_A_2
QMean=0.474 		P2: (5 Cplx.) RUN0 DOpKi= 7.2
226 6.6 2.31039055774I22 (99%) + IRE_A_2
QMean=0.468 		P2: (3 Cplx.) RUN2 DOpKi= 5.9
227 7.5 2.41039044514I24 (99%) + 1C9_A_3
QMean=0.490 		P2: (3 Cplx.) RUN2 DOpKi= 6.4
228 6.3 1.31039048194JRV (100%) + KJV_A_2
QMean=0.473 		P2: (7 Cplx.) RUN1 DOpKi= 6.6
229 8.2 2.3103904712U170 (100%) + xxx_A_2
QMean=0.489 		P2: (4 Cplx.) RUN0 DOpKi= 6.1
230 8.9 2.51039047522R4B (80%) + GW7_A_3
QMean=0.520 		P2: (3 Cplx.) RUN0 DOpKi= 5.8
231 6.9 1.41039042144I24 (99%) + 1C9_A_3
QMean=0.490 		P2: (8 Cplx.) RUN1 DOpKi= 5.8
232 6.4 2.1103905259U154 (100%) + xxx_A_2
QMean=0.474 		P2: (4 Cplx.) RUN0 DOpKi= 6.4
233 6.9 2.01039050564I22 (99%) + IRE_A_2
QMean=0.468 		P2: (4 Cplx.) RUN2 DOpKi= 5.9
234 9.7 1.11039049913W33 (100%) + W19_A_2
QMean=0.487 		P2: (3 Cplx.) RUN2 DOpKi= 7.5
235 8.2 2.3103904308U173 (100%) + xxx_A_2
QMean=0.489 		P2: (7 Cplx.) RUN0 DOpKi= 6.3
236 7.5 2.3103904349U172 (100%) + xxx_A_2
QMean=0.489 		P2: (4 Cplx.) RUN0 DOpKi= 6.3
237 6.2 1.1103905540U154 (100%) + xxx_A_2
QMean=0.474 		P2: (4 Cplx.) RUN0 DOpKi= 7.6
238 7.9 1.61039047883W32 (100%) + W32_A_2
QMean=0.498 		P2: (3 Cplx.) RUN2 DOpKi= 6.1
239 7.1 1.21039055322ITQ (99%) + STU_A_2
QMean=0.421 		P2: (3 Cplx.) RUN0 DOpKi= 7.7
240 7.7 2.44LI5_1WYU160 (100%) + xxx_A_2
QMean=0.489 		P2: (3 Cplx.) VALID0 DO-= -
241 6.8 1.91039048283BEL (100%) + POX_A_4
QMean=0.459 		P2: (3 Cplx.) RUN2 DOpKi= 6.7
242 6.3 2.44RJ4_3QW3BEL (100%) + POX_A_4
QMean=0.459 		P2: (3 Cplx.) VALID0 DO-= -
243 6.2 1.21039042014JRV (100%) + KJV_A_2
QMean=0.473 		P2: (5 Cplx.) RUN2 DOpKi= 6.2
244 9.3 1.7103904779U165 (100%) + xxx_A_2
QMean=0.508 		P2: (3 Cplx.) RUN0 DOpKi= 5.8
245 7.6 1.91039041944I24 (99%) + 1C9_A_3
QMean=0.490 		P2: (5 Cplx.) RUN1 DOpKi= 6
246 6.6 1.71039054824JRV (100%) + KJV_A_2
QMean=0.473 		P2: (5 Cplx.) RUN1 DOpKi= 5.8
247 6.0 1.61039045934I24 (99%) + 1C9_A_3
QMean=0.490 		P3: (4 Cplx.) RUN1 DOpKi= 6.5
248 7.6 0.71039051403LZB (99%) + ITI_B_10
QMean=0.501 		P3: (3 Cplx.) RUN0 DOpKi= 7.7
249 6.8 2.31039047124FYO (42%) + 0VF_A_2
QMean=0.445 		P3: (4 Cplx.) RUN1 DOpKi= 6.1
250 6.0 1.31039042113POZ (100%) + 03P_A_5
QMean=0.479 		P3: (3 Cplx.) RUN0 DOpKi= 6
251 7.9 1.11039047794JRV (100%) + KJV_A_2
QMean=0.473 		P3: (4 Cplx.) RUN1 ODpKi= 5.8
252 7.9 2.21039045964I24 (99%) + 1C9_B_4
QMean=0.462 		P3: (3 Cplx.) RUN0 DOpKi= 6.4
253 6.4 1.61039055403PP0 (78%) + 03Q_B_4
QMean=0.457 		P3: (4 Cplx.) RUN1 DOpKi= 7.6
254 6.8 1.61039041923POZ (100%) + 03P_A_5
QMean=0.479 		P3: (3 Cplx.) RUN2 ODpKi= 6.7
255 8.1 2.21039045914AOJ (34%) + V4Z_A_4
QMean=0.472 		P3: (3 Cplx.) RUN0 ODpKi= 7.1
256 6.6 1.9103904204U159 (100%) + xxx_A_2
QMean=0.489 		P3: (3 Cplx.) RUN0 ODpKi= 6.1
257 4.6 1.91039052094FYO (42%) + 0VF_A_2
QMean=0.445 		P3: (3 Cplx.) RUN2 DOpKi= 6.7
258 5.0 1.81039049583POZ (100%) + 03P_A_5
QMean=0.479 		P3: (3 Cplx.) RUN2 DOpKi= 6.5
259 6.5 2.14LI5_1WYU158 (100%) + xxx_A_2
QMean=0.489 		P3: (3 Cplx.) VALID2 DO-= -
260 8.6 1.8103905067U153 (100%) + xxx_A_2
QMean=0.480 		P3: (3 Cplx.) RUN0 DOpKi= 5.9
261 7.3 2.01039054964I22 (99%) + IRE_A_2
QMean=0.468 		P3: (3 Cplx.) RUN1 DOpKi= 6.6
262 7.5 1.74RJ4_3QWU166 (100%) + xxx_A_2
QMean=0.462 		P3: (4 Cplx.) VALID2 DO-= -
263 7.1 2.41039045502ITO (99%) + IRE_A_2
QMean=0.431 		P3: (5 Cplx.) RUN0 DOpKi= 7.4
264 8.0 2.21039042724I24 (99%) + 1C9_A_3
QMean=0.490 		P3: (3 Cplx.) RUN2 DOpKi= 6.3
265 6.9 2.11039041894I24 (99%) + 1C9_A_3
QMean=0.490 		P3: (3 Cplx.) RUN1 ODpKi= 6.1
266 8.1 1.71039052503IKA (99%) + 0UN_A_3
QMean=0.462 		P3: (3 Cplx.) RUN1 DOpKi= 6.4
267 6.3 1.71039042014JRV (100%) + KJV_A_2
QMean=0.473 		P3: (4 Cplx.) RUN0 DOpKi= 6.2
268 6.2 2.31039049124I24 (99%) + 1C9_A_3
QMean=0.490 		P3: (3 Cplx.) RUN2 DOpKi= 6.3
269 7.7 2.4103904189U161 (100%) + xxx_A_2
QMean=0.510 		P3: (3 Cplx.) RUN0 ODpKi= 6.1
270 7.4 1.51039054454JRV (100%) + KJV_A_2
QMean=0.473 		P3: (3 Cplx.) RUN1 DOpKi= 5.8
271 4.7 1.61039044034I22 (99%) + IRE_A_2
QMean=0.468 		P4: (3 Cplx.) RUN1 DOpKi= 6

Correlation coefficient (Pearson) between mesured and calculated pKd: R=0.07



Action on selected entries :