Query sequence : GSK3A_HUMAN: (2015-10-08 ) MSGGGPSGGGPGGSGRARTSSFAEPGGGGGGGGGGPGGSASGPGGTGGGKASVGAMGGGVGASSSGGGPGGSGGGGSGGPGAGTSFPPPGVKLGRDSGKVTTVVATLGQGPERSQEVAYTDIKVIGNGSFGVVYQARLAETRELVAIKKVLQDKRFKNRELQIMRKLDHCNIVRLRYFFYSSGEKKDELYLNLVLEYVPETVYRVARHFTKAKLTIPILYVKVYMYQLFRSLAYIHSQGVCHRDIKPQNLLVDPDTAVLKLCDFGSAKQLVRGEPNVSYICSRYYRAPELIFGATDYTSSIDVWSAGCVLAELLLGQPIFPGDSGVDQLVEIIKVLGTPTREQIREMNPNYTEFKFPQIKAHPWTKVFKSRTPPEAIALCSSLLEYTPSSRLSPLEACAHSFFDELRCLGTQLPNNRPLPPLFNFSAGELSIQPSLNAILIPPHLRSPAGTTTLTPSSQALTETPTSSDWQSTDATPTLTNSS

Atome Classification :

	(87 SA)										Binding Score for complex ligand / Scwrl (Unconserved SChains Recalculated) model (Only selected ligand are displayed)
			(Atome)	(Ident)	(Tito)	(Num)		(pKd)	(Uniprot)		MPD_B_8(3SAY) GSK3B_HUMAN [Raw transfer] OFT_B_6(3SAY) GSK3B_HUMAN [Raw transfer] OFT_A_3(3SAY) GSK3B_HUMAN [Raw transfer] ADP_A_5(1J1C) GSK3B_HUMAN [Raw transfer] ANP_C_3(1J1B) GSK3B_HUMAN [Raw transfer] ANP_C_3(1J1B) GSK3B_HUMAN [Raw transfer] ADP_B_6(1J1C) GSK3B_HUMAN [Raw transfer] DW1_B_4(3M1S) GSK3B_HUMAN [Raw transfer] ADP_A_10(4NM0) GSK3B_HUMAN [Raw transfer] ANP_D_4(1J1B) GSK3B_HUMAN [Raw transfer] ANP_A_7(1PYX) GSK3B_HUMAN [Raw transfer] HBM_A_2(2O5K) GSK3B_HUMAN [Raw transfer] ANP_B_8(1PYX) GSK3B_HUMAN [Raw transfer] ANP_A_5(4IC7) MK07_HUMAN [Raw transfer] ADP_A_4(4NM7) GSK3B_HUMAN [Raw transfer] OS1_B_4(3PUP) GSK3B_HUMAN [Raw transfer] DRK_A_3(3EB0) ? [Raw transfer] ADP_A_4(4NM5) GSK3B_HUMAN [Raw transfer] Z92_B_5(3L1S) GSK3B_HUMAN [Raw transfer] OS1_A_3(3PUP) GSK3B_HUMAN [Raw transfer] ADP_A_4(3NIZ) ? [Raw transfer] DRK_A_3(3EB0) ? [Raw transfer] ADP_A_4(2B9H) FUS3_YEAST [Raw transfer] BIM_A_3(2OW3) GSK3B_HUMAN [Raw transfer] BIM_B_4(2OW3) GSK3B_HUMAN [Raw transfer] IQ6_B_4(4IQ6) GSK3B_HUMAN [Raw transfer] AG1_B_5(2JLD) GSK3B_HUMAN [Raw transfer] 99Z_A_3(3SQQ) CDK2_HUMAN [Raw transfer] GOL_B_17(4AFJ) GSK3B_HUMAN [Raw transfer] ATP_E_5(1UA2) CDK7_HUMAN [Raw transfer] 20Z_A_2(3RMF) CDK2_HUMAN [Raw transfer] Z48_B_4(3I4B) GSK3B_HUMAN [Raw transfer] EZV_A_2(3EZV) CDK2_HUMAN [Raw transfer] AG1_A_4(2JLD) GSK3B_HUMAN [Raw transfer] STU_A_2(4EZ7) CDK2_HUMAN [Raw transfer] 34O_B_4(3F7Z) GSK3B_HUMAN [Raw transfer] 2WF_B_4(4PTE) GSK3B_HUMAN [Raw transfer] GNP_A_2(4JR7) CSK21_YEAST [Raw transfer] 2WG_B_4(4PTG) GSK3B_HUMAN [Raw transfer] EZR_A_2(3EZR) CDK2_HUMAN [Raw transfer] STU_D_4(1Q3D) GSK3B_HUMAN [Raw transfer] G3B_A_2(3GB2) GSK3B_HUMAN [Raw transfer] 56Z_A_2(3S1H) CDK2_HUMAN [Raw transfer] 34O_A_3(3F7Z) GSK3B_HUMAN [Raw transfer] 679_B_4(1Q4L) GSK3B_HUMAN [Raw transfer] 38R_A_3(4BGQ) CDKL5_HUMAN [Raw transfer] Z92_A_3(3L1S) GSK3B_HUMAN [Raw transfer] 2WG_A_3(4PTG) GSK3B_HUMAN [Raw transfer] 679_A_3(1Q4L) GSK3B_HUMAN [Raw transfer] 55E_A_3(3Q3B) GSK3B_HUMAN [Raw transfer] 55E_B_4(3Q3B) GSK3B_HUMAN [Raw transfer] 553_B_4(3DU8) GSK3B_HUMAN [Raw transfer] 19Z_A_3(3RM7) CDK2_HUMAN [Raw transfer] ATU_D_4(1Q3W) GSK3B_HUMAN [Raw transfer] X64_A_6(4GCJ) CDK2_HUMAN [Raw transfer] 2WE_B_4(4PTC) GSK3B_HUMAN [Raw transfer] 2WF_A_3(4PTE) GSK3B_HUMAN [Raw transfer] ZRM_A_9(3ZRM) GSK3B_HUMAN [Raw transfer] 0S0_A_2(4EZ3) CDK2_HUMAN [Raw transfer] 553_A_3(3DU8) GSK3B_HUMAN [Raw transfer] SJJ_B_19(4AFJ) GSK3B_HUMAN [Raw transfer] IQ6_A_3(4IQ6) GSK3B_HUMAN [Raw transfer] ZRK_B_15(3ZRK) GSK3B_HUMAN [Raw transfer] ZRK_A_9(3ZRK) GSK3B_HUMAN [Raw transfer] ATU_C_3(1Q3W) GSK3B_HUMAN [Raw transfer] STU_C_3(1Q3D) GSK3B_HUMAN [Raw transfer] 26Z_A_3(3RPV) CDK2_HUMAN [Raw transfer] 2WE_A_3(4PTC) GSK3B_HUMAN [Raw transfer] CWT_A_3(4B7T) GSK3B_HUMAN [Raw transfer] 24Z_A_3(3RPO) CDK2_HUMAN [Raw transfer] 21Z_A_2(3RNI) CDK2_HUMAN [Raw transfer] 25Z_A_2(3RPR) CDK2_HUMAN [Raw transfer] SJJ_A_11(4AFJ) GSK3B_HUMAN [Raw transfer] 22Z_A_3(3ROY) CDK2_HUMAN [Raw transfer] 50Z_A_2(3S0O) CDK2_HUMAN [Raw transfer] 02Z_A_2(3RZB) CDK2_HUMAN [Raw transfer] 2HT_A_4(3F88) GSK3B_HUMAN [Raw transfer] 2HT_B_6(3F88) GSK3B_HUMAN [Raw transfer] JBI_A_2(3TTJ) MK10_HUMAN [Raw transfer] Z60_A_2(3S00) CDK2_HUMAN [Raw transfer] TMU_D_4(1Q5K) GSK3B_HUMAN [Raw transfer] 27Z_A_2(3RPY) CDK2_HUMAN [Raw transfer] UGJ_A_4(3ZDI) GSK3B_HUMAN [Raw transfer] 1JX_B_7(4J71) GSK3B_HUMAN [Raw transfer] TMU_C_3(1Q5K) GSK3B_HUMAN [Raw transfer] ADZ_A_3(1O9U) GSK3B_HUMAN [Raw transfer] 1JX_A_3(4J71) GSK3B_HUMAN [Raw transfer] 2AN_A_3(4EZ7) CDK2_HUMAN [Raw transfer] NIO_A_2(3WAR) CSK21_HUMAN [Raw transfer] 1CK_A_2(4EK4) CDK2_HUMAN [Raw transfer] EDO_A_3(4EZ3) CDK2_HUMAN [Raw transfer]
77	PsiBlast_CBE		95.97	85%	-136	- C1 -	2OW3	9.2	GSK3B_HUMAN
54	PsiBlast_CBE		94.25	85%	-129	- C1 -	4NM7	4.3	GSK3B_HUMAN
84	PsiBlast_CBE		94.13	85%	-132	- C1 -	3F88	2.5	GSK3B_HUMAN
55	PsiBlast_CBE		94.04	85%	-131	- C1 -	4NM5	4.7	GSK3B_HUMAN
76	PsiBlast_CBE		94.02	85%	-130	- C1 -	2OW3	9.2	GSK3B_HUMAN
80	PsiBlast_CBE		93.89	85%	-135	- C1 -	3F7Z	5.6	GSK3B_HUMAN
56	PsiBlast_CBE		93.88	82%	-131	- C1 -	4J71	3.2	GSK3B_HUMAN
52	PsiBlast_CBE		93.83	82%	-130	- C1 -	3SAY	6.1	GSK3B_HUMAN
86	PsiBlast_CBE		93.80	84%	-128	- C1 -	1O9U	3.3	GSK3B_HUMAN
36	PsiBlast_CBE		93.79	82%	-132	- C1 -	4PTC	4.8	GSK3B_HUMAN
18	PsiBlast_PDB		93.75	82%	-131	- C1 -	1J1C	4.8	GSK3B_HUMAN
70	PsiBlast_CBE		93.64	86%	-126	- C1 -	4B7T	5.6	GSK3B_HUMAN
20	PsiBlast_PDB		93.63	82%	-132	- C1 -	3PUP	8.6	GSK3B_HUMAN
53	PsiBlast_CBE		93.60	82%	-133	- C1 -	3SAY	6.1	GSK3B_HUMAN
7	PsiBlast_PDB		93.60	78%	-133	- C1 -	1Q3W	5.7	GSK3B_HUMAN
51	PsiBlast_CBE		93.50	80%	-128	- C1 -	4NM0	4.7	GSK3B_HUMAN
17	PsiBlast_PDB		93.47	82%	-132	- C1 -	1J1B	4.8	GSK3B_HUMAN
35	PsiBlast_CBE		93.46	82%	-130	- C1 -	4PTE	6.5	GSK3B_HUMAN
14	PsiBlast_PDB		93.41	82%	-132	- C1 -	4PTE	6.5	GSK3B_HUMAN
40	PsiBlast_CBE		93.33	82%	-128	- C1 -	1J1C	4.8	GSK3B_HUMAN
11	PsiBlast_PDB		93.33	82%	-133	- C1 -	1Q5K	4.7	GSK3B_HUMAN
37	PsiBlast_CBE		93.31	82%	-131	- C1 -	3PUP	8.7	GSK3B_HUMAN
48	PsiBlast_CBE		93.30	84%	-133	- C1 -	2O5K	7.3	GSK3B_HUMAN
46	PsiBlast_CBE		93.18	82%	-131	- C1 -	1PYX	6.0	GSK3B_HUMAN
15	PsiBlast_PDB		93.10	82%	-135	- C1 -	4PTG	6.0	GSK3B_HUMAN
85	PsiBlast_CBE		93.06	85%	-129	- C1 -	3F88	2.5	GSK3B_HUMAN
73	PsiBlast_CBE		93.02	83%	-127	- C1 -	4AFJ	5.7	GSK3B_HUMAN
43	PsiBlast_CBE		92.96	82%	-133	- C1 -	3DU8	5.5	GSK3B_HUMAN
57	PsiBlast_CBE		92.75	82%	-131	- C1 -	4J71	3.1	GSK3B_HUMAN
44	PsiBlast_CBE		92.73	82%	-132	- C1 -	3DU8	5.4	GSK3B_HUMAN
78	PsiBlast_CBE		92.68	85%	-131	- C1 -	3GB2	5.6	GSK3B_HUMAN
13	PsiBlast_PDB		92.59	82%	-137	- C1 -	4PTC	3.6	GSK3B_HUMAN
68	PsiBlast_CBE		92.58	83%	-127	- C1 -	3ZRK	5.2	GSK3B_HUMAN
19	PsiBlast_PDB		92.54	82%	-129	- C1 -	2JLD	8.9	GSK3B_HUMAN
39	PsiBlast_CBE		92.45	82%	-128	- C1 -	2JLD	9.2	GSK3B_HUMAN
41	PsiBlast_CBE		92.36	82%	-126	- C1 -	1J1B	4.8	GSK3B_HUMAN
74	PsiBlast_CBE		92.35	83%	-128	- C1 -	4AFJ	5.7	GSK3B_HUMAN
81	PsiBlast_CBE		92.32	85%	-128	- C1 -	3F7Z	6.4	GSK3B_HUMAN
10	PsiBlast_PDB		92.29	78%	-131	- C1 -	3Q3B	5.8	GSK3B_HUMAN
65	PsiBlast_CBE		92.23	83%	-128	- C1 -	3ZRM	5.8	GSK3B_HUMAN
34	PsiBlast_CBE		92.11	82%	-133	- C1 -	4PTG	6.1	GSK3B_HUMAN
69	PsiBlast_CBE		91.93	83%	-127	- C1 -	3ZRK	5.0	GSK3B_HUMAN
33	PsiBlast_CBE		91.90	82%	-126	- C1 -	1Q5K	4.4	GSK3B_HUMAN
38	PsiBlast_CBE		91.73	82%	-128	- C1 -	3M1S	7.9	GSK3B_HUMAN
6	PsiBlast_PDB		91.71	78%	-134	- C1 -	1Q3D	7.5	GSK3B_HUMAN
79	PsiBlast_CBE		91.66	85%	-126	- C1 -	3ZDI	5.2	GSK3B_HUMAN
31	PsiBlast_CBE		91.55	82%	-134	- C1 -	3L1S	7.4	GSK3B_HUMAN
30	PsiBlast_CBE		91.55	78%	-134	- C1 -	1Q3D	7.6	GSK3B_HUMAN
45	PsiBlast_CBE		91.40	82%	-132	- C1 -	1PYX	5.1	GSK3B_HUMAN
117	HHSearch		91.36	75%	-132	- C1 -	1J1B	4.8	GSK3B_HUMAN
26	PsiBlast_CBE		91.20	78%	-129	- C1 -	3Q3B	5.8	GSK3B_HUMAN
29	PsiBlast_CBE		91.19	78%	-132	- C1 -	1Q3W	5.3	GSK3B_HUMAN
21	PsiBlast_CBE		91.16	77%	-136	- C1 -	4IQ6	6.7	GSK3B_HUMAN
12	PsiBlast_PDB		91.05	82%	-131	- C1 -	3L1S	6.3	GSK3B_HUMAN
32	PsiBlast_CBE		91.02	82%	-126	- C1 -	3I4B	8.5	GSK3B_HUMAN
9	PsiBlast_PDB		90.63	78%	-131	- C1 -	1Q4L	6.7	GSK3B_HUMAN
27	PsiBlast_CBE		89.21	78%	-130	- C1 -	1Q4L	6.8	GSK3B_HUMAN
1	PsiBlast_PDB		88.86	77%	-133	- C1 -	4IQ6	6.9	GSK3B_HUMAN
119	HHSearch		76.69	51%	-136	* C1 *	3EB0	6.4	?
87	PsiBlast_CBE		74.19	47%	-138	- C1 -	3EB0	6.4	?
88	PsiBlast_CBE		54.88	35%	-133	- C1 -	3NIZ	4.4	?
90	PsiBlast_CBE		54.86	35%	-141	- C1 -	3EZR	4.0	CDK2_HUMAN
123	HHSearch		54.76	34%	-128	- C1 -	4IC7	5.3	MK07_HUMAN
89	PsiBlast_CBE		54.00	35%	-139	- C1 -	3EZV	4.9	CDK2_HUMAN
127	HHSearch		53.78	31%	-128	- C1 -	3TTJ	7.8	MK10_HUMAN
129	HHSearch		53.71	33%	-119	- C1 -	2B9H	4.7	FUS3_YEAST
95	PsiBlast_CBE		53.31	35%	-136	- C1 -	3S1H	5.3	CDK2_HUMAN
99	PsiBlast_CBE		52.97	35%	-138	- C1 -	3RPY	4.1	CDK2_HUMAN
105	PsiBlast_CBE		52.80	35%	-136	- C1 -	3RMF	6.6	CDK2_HUMAN
133	HHSearch		52.23	38%	-119	- C1 -	4BGQ	6.2	CDKL5_HUMAN
141	HHSearch		52.07	31%	-121	- C1 -	4JR7	5.2	CSK21_YEAST
101	PsiBlast_CBE		51.81	35%	-133	- C1 -	3RPR	6.9	CDK2_HUMAN
104	PsiBlast_CBE		51.71	35%	-136	- C1 -	3RNI	4.5	CDK2_HUMAN
91	PsiBlast_CBE		51.55	35%	-126	- C1 -	4GCJ	4.7	CDK2_HUMAN
98	PsiBlast_CBE		51.54	35%	-135	- C1 -	3RZB	4.1	CDK2_HUMAN
94	PsiBlast_CBE		51.39	35%	-135	- C1 -	3SQQ	5.9	CDK2_HUMAN
100	PsiBlast_CBE		51.29	35%	-134	- C1 -	3RPV	4.9	CDK2_HUMAN
137	HHSearch		50.79	31%	-122	- C1 -	3WAR	2.5	CSK21_HUMAN
92	PsiBlast_CBE		50.69	35%	-122	- C1 -	4EZ7	7.6	CDK2_HUMAN
102	PsiBlast_CBE		50.61	35%	-129	- C1 -	3RPO	5.7	CDK2_HUMAN
106	PsiBlast_CBE		50.29	35%	-134	- C1 -	3RM7	3.7	CDK2_HUMAN
97	PsiBlast_CBE		50.29	35%	-133	- C1 -	3S00	3.9	CDK2_HUMAN
103	PsiBlast_CBE		50.16	35%	-129	- C1 -	3ROY	6.1	CDK2_HUMAN
93	PsiBlast_CBE		50.15	35%	-131	- C1 -	4EZ3	3.6	CDK2_HUMAN
128	HHSearch		49.78	36%	-115	- C1 -	1UA2	5.5	CDK7_HUMAN
96	PsiBlast_CBE		49.43	35%	-133	- C1 -	3S0O	4.2	CDK2_HUMAN
143	HHSearch		13.80	35%	-20	- C1 -	4EK4	2.5	CDK2_HUMAN