Query sequence : KCC1A_HUMAN: (2013-07-21 ) MLGAVEGPRWKQAEDIRDIYDFRDVLGTGAFSEVILAEDKRTQKLVAIKCIAKEALEGKEGSMENEIAVLHKIKHPNIVALDDIYESGGHLYLIMQLVSGGELFDRIVEKGFYTERDASRLIFQVLDAVKYLHDLGIVHRDLKPENLLYYSLDEDSKIMISDFGLSKMEDPGSVLSTACGTPGYVAPEVLAQKPYSKAVDCWSIGVIAYILLCGYPPFYDENDAKLFEQILKAEYEFDSPYWDDISDSAKDFIRHLMEKDPEKRFTCEQALQHPWIAGDTALDKNIHQSVSEQIKKNFAKSKWKQAFNATAVVRHMRKLQLGTSQEGQGQTASHGELLTPVAGGPAAGCCCRDCCVEPGTELSPTLPHQL

Atome Classification :

	(92 SA)										Binding Score for complex ligand / Scwrl (Unconserved SChains Recalculated) model (Only selected ligand are displayed)
			(Atome)	(Ident)	(Tito)	(Num)		(pKd)	(Uniprot)		ATP_A_3(4FG9) KCC1A_HUMAN [Raw transfer] ATP_A_3(4FG8) KCC1A_HUMAN [Raw transfer] ATP_B_4(4FG9) KCC1A_HUMAN [Raw transfer] ATP_A_2(4FG7) KCC1A_HUMAN [Raw transfer] ANP_A_3(3GU5) DAPK1_HUMAN [Raw transfer] ANP_A_2(3F5U) DAPK1_HUMAN [Raw transfer] ANP_A_2(3GU4) DAPK1_HUMAN [Raw transfer] ANP_B_2(3DFC) DAPK1_HUMAN [Raw transfer] ATP_B_4(4FG8) KCC1A_HUMAN [Raw transfer] ANP_A_3(1IG1) DAPK1_HUMAN [Raw transfer] ANP_A_2(1JKL) DAPK1_HUMAN [Raw transfer] ADP_A_2(3EH9) DAPK1_HUMAN [Raw transfer] ANP_A_5(3IGO) ? [Raw transfer] ATP_B_6(2YAA) DAPK2_MOUSE [Raw transfer] ANP_A_2(3EHA) DAPK1_HUMAN [Raw transfer] ADP_A_6(2CN5) CHK2_HUMAN [Raw transfer] ADP_A_2(2XUU) DAPK1_HUMAN [Raw transfer] ADP_A_2(3GU6) DAPK1_HUMAN [Raw transfer] ANP_A_3(1JKK) DAPK1_HUMAN [Raw transfer] ADP_A_2(3GU7) DAPK1_HUMAN [Raw transfer] ADP_A_2(2W4K) DAPK1_HUMAN [Raw transfer] ANP_A_8(3Q5I) ? [Raw transfer] ANP_A_6(3HX4) ? [Raw transfer] QPP_C_4(2JC6) KCC1D_HUMAN [Raw transfer] ATP_A_3(2YAA) DAPK2_MOUSE [Raw transfer] QPP_A_3(2JC6) KCC1D_HUMAN [Raw transfer] GVD_A_7(2VN9) KCC2D_HUMAN [Raw transfer] GOL_A_12(3HX4) ? [Raw transfer] GOL_A_4(3HZT) ? [Raw transfer] K88_A_3(2WEL) KCC2D_HUMAN [Raw transfer] ANP_A_7(3LIJ) ? [Raw transfer] ACP_D_13(3ZXT) DAPK1_HUMAN [Raw transfer] GVD_B_8(2VN9) KCC2D_HUMAN [Raw transfer] GOL_A_9(3HZT) ? [Raw transfer] RU9_A_3(4A9S) CHK2_HUMAN [Raw transfer] ANP_A_2(3KU2) ? [Raw transfer] LWH_A_2(2XM9) CHK2_HUMAN [Raw transfer] ZZK_A_2(2WTD) CHK2_HUMAN [Raw transfer] 5CP_B_6(3BHH) KCC2B_HUMAN [Raw transfer] 5CP_A_5(3BHH) KCC2B_HUMAN [Raw transfer] VGM_A_2(2WTC) CHK2_HUMAN [Raw transfer] J60_A_7(3HZT) ? [Raw transfer] B6A_A_2(3UPX) ? [Raw transfer] WTI_A_2(2WTI) CHK2_HUMAN [Raw transfer] DBQ_A_4(2CN8) CHK2_HUMAN [Raw transfer] B49_A_5(2Y7J) PHKG2_HUMAN [Raw transfer] B49_D_8(2Y7J) PHKG2_HUMAN [Raw transfer] BK7_A_2(3SX9) ? [Raw transfer] YIR_A_2(2YIR) CHK2_HUMAN [Raw transfer] RU5_A_3(4A9R) CHK2_HUMAN [Raw transfer] A9T_A_2(4A9T) CHK2_HUMAN [Raw transfer] A9U_A_4(4A9U) CHK2_HUMAN [Raw transfer] B49_C_7(2Y7J) PHKG2_HUMAN [Raw transfer] 0XZ_A_2(4GV1) AKT1_HUMAN [Raw transfer] BK6_A_2(3T3U) ? [Raw transfer] UW9_A_2(3V5T) ? [Raw transfer] J60_A_6(2JAM) KCC1G_HUMAN [Raw transfer] P3J_A_2(4BDG) ? [Raw transfer] C88_A_2(3V5P) ? [Raw transfer] J60_A_6(2JAM) KCC1G_HUMAN [Raw transfer] DRG_A_2(1P4F) DAPK1_HUMAN [Raw transfer] B5A_A_2(3UPZ) ? [Raw transfer] J60_B_10(2JAM) KCC1G_HUMAN [Raw transfer] DTQ_A_2(3NYV) ? [Raw transfer] MES_A_2(2Y0A) DAPK1_HUMAN [Raw transfer] BK5_A_2(3SXF) ? [Raw transfer] H3R_A_2(4BDF) ? [Raw transfer] I76_A_2(3V51) ? [Raw transfer] CWS_A_4(4BDE) ? [Raw transfer] WVI_A_3(4BDH) ? [Raw transfer] DXR_A_3(3MA6) ? [Raw transfer] BK3_A_6(3MWU) ? [Raw transfer] Z2M_A_2(4BDJ) ? [Raw transfer] YIQ_A_2(2YIQ) CHK2_HUMAN [Raw transfer] BK3_A_2(3N51) ? [Raw transfer] BK1_A_2(3I7B) ? [Raw transfer] VFB_A_4(4BDA) ? [Raw transfer] DKI_A_2(2W4O) KCC4_HUMAN [Raw transfer] UPX_A_2(2YCQ) CHK2_HUMAN [Raw transfer] DRN_A_2(2V7O) KCC2G_HUMAN [Raw transfer] BK4_A_2(3T3V) ? [Raw transfer] BK1_A_5(3NCG) ? [Raw transfer] DXR_B_4(3MA6) ? [Raw transfer] HCW_A_2(2YCR) CHK2_HUMAN [Raw transfer] ZAT_A_2(2W0J) CHK2_HUMAN [Raw transfer] WTJ_A_2(2WTJ) CHK2_HUMAN [Raw transfer] EDO_A_5(2JAM) KCC1G_HUMAN [Raw transfer] EDO_B_8(2JAM) KCC1G_HUMAN [Raw transfer] EDO_A_5(2JAM) KCC1G_HUMAN [Raw transfer] YCF_A_2(2YCF) CHK2_HUMAN [Raw transfer] HAU_A_2(4BDI) ? [Raw transfer] YIT_A_2(2YIT) CHK2_HUMAN [Raw transfer] NXP_A_2(2YCS) CHK2_HUMAN [Raw transfer] EDO_A_3(4BDE) ? [Raw transfer] RQQ_A_2(4BDK) ? [Raw transfer] ODO_A_4(4BDB) ? [Raw transfer] ODH_A_2(4BDC) ? [Raw transfer] Z0O_A_3(4BDD) ? [Raw transfer] DB8_A_2(3SOA) KCC2A_HUMAN [Raw transfer] SL0_A_2(3UBD) KS6A3_MOUSE [Raw transfer] EDO_A_3(3I7B) ? [Raw transfer] EDO_A_4(2WEL) KCC2D_HUMAN [Raw transfer] EDO_A_4(3T3U) ? [Raw transfer]
4	PsiBlast_PDB		87.71	100%	-145	- C1 -	4FG8	6.3	KCC1A_HUMAN
2	PsiBlast_PDB		86.49	100%	-129	- C1 -	4FG9	5.8	KCC1A_HUMAN
6	PsiBlast_PDB		86.46	84%	-136	- C1 -	2JC6	6.9	KCC1D_HUMAN
23	PsiBlast_CBE		86.25	84%	-137	- C1 -	2JC6	6.8	KCC1D_HUMAN
115	HHSearch		85.93	100%	-147	- C1 -	4FG7	4.6	KCC1A_HUMAN
21	PsiBlast_CBE		84.58	100%	-133	- C1 -	4FG9	6.1	KCC1A_HUMAN
22	PsiBlast_CBE		81.64	100%	-140	- C1 -	4FG8	4.6	KCC1A_HUMAN
125	HHSearch		73.72	71%	-125	- C1 -	2JAM	6.5	KCC1G_HUMAN
24	PsiBlast_CBE		73.35	70%	-123	- C1 -	2JAM	6.4	KCC1G_HUMAN
14	PsiBlast_PDB		65.33	41%	-122	- C1 -	2WEL	5.8	KCC2D_HUMAN
18	PsiBlast_PDB		63.78	41%	-112	- C1 -	3BHH	4.5	KCC2B_HUMAN
134	HHSearch		63.49	39%	-113	- C1 -	3MWU	7.3	?
79	PsiBlast_CBE		62.59	37%	-111	* C1 *	2YAA	5.6	DAPK2_MOUSE
80	PsiBlast_CBE		62.03	37%	-113	- C1 -	2YAA	5.1	DAPK2_MOUSE
11	PsiBlast_PDB		61.77	41%	-109	- C1 -	2V7O	6.4	KCC2G_HUMAN
29	PsiBlast_CBE		61.02	41%	-112	- C1 -	3BHH	6.0	KCC2B_HUMAN
60	PsiBlast_CBE		60.82	43%	-124	- C1 -	3IGO	5.3	?
16	PsiBlast_PDB		60.32	41%	-106	- C1 -	2VN9	6.9	KCC2D_HUMAN
26	PsiBlast_CBE		59.78	41%	-105	- C1 -	2VN9	6.9	KCC2D_HUMAN
13	PsiBlast_PDB		59.74	44%	-135	- C1 -	3LIJ	4.0	?
123	HHSearch		58.52	38%	-128	- C1 -	4GV1	6.2	AKT1_HUMAN
90	PsiBlast_CBE		58.45	40%	-123	- C1 -	2Y0A	2.2	DAPK1_HUMAN
17	PsiBlast_PDB		57.54	43%	-126	- C1 -	3HZT	6.3	?
58	PsiBlast_CBE		57.25	43%	-129	- C1 -	3NCG	5.9	?
85	PsiBlast_CBE		57.24	40%	-119	- C1 -	2Y7J	5.8	PHKG2_HUMAN
102	PsiBlast_CBE		57.10	40%	-117	- C1 -	1JKK	4.8	DAPK1_HUMAN
52	PsiBlast_CBE		57.02	41%	-120	- C1 -	2YIT	7.5	CHK2_HUMAN
96	PsiBlast_CBE		56.88	40%	-118	- C1 -	3DFC	6.9	DAPK1_HUMAN
44	PsiBlast_CBE		56.67	41%	-120	- C1 -	4A9R	6.1	CHK2_HUMAN
38	PsiBlast_CBE		56.30	41%	-123	- C1 -	4BDC	5.2	?
100	PsiBlast_CBE		56.23	40%	-117	- C1 -	3EH9	5.5	DAPK1_HUMAN
56	PsiBlast_CBE		56.05	41%	-119	- C1 -	2YCQ	8.5	CHK2_HUMAN
19	PsiBlast_PDB		55.99	41%	-118	- C1 -	2YCR	6.8	CHK2_HUMAN
92	PsiBlast_CBE		55.98	40%	-116	- C1 -	3GU6	4.5	DAPK1_HUMAN
103	PsiBlast_CBE		55.89	40%	-116	- C1 -	1IG1	5.8	DAPK1_HUMAN
30	PsiBlast_CBE		55.87	41%	-120	- C1 -	4BDK	5.9	?
101	PsiBlast_CBE		55.85	40%	-118	- C1 -	1JKL	6.4	DAPK1_HUMAN
8	PsiBlast_PDB		55.79	47%	-118	- C1 -	2W4O	5.3	KCC4_HUMAN
43	PsiBlast_CBE		55.63	41%	-121	- C1 -	4A9S	6.1	CHK2_HUMAN
32	PsiBlast_CBE		55.63	41%	-118	- C1 -	4BDI	4.4	?
62	PsiBlast_CBE		55.62	42%	-130	- C1 -	3HX4	4.3	?
83	PsiBlast_CBE		55.60	38%	-109	- C1 -	2XUU	5.7	DAPK1_HUMAN
48	PsiBlast_CBE		55.47	41%	-121	- C1 -	2WTD	6.9	CHK2_HUMAN
86	PsiBlast_CBE		55.41	40%	-121	- C1 -	2Y7J	6.4	PHKG2_HUMAN
99	PsiBlast_CBE		55.04	40%	-118	- C1 -	3EHA	6.6	DAPK1_HUMAN
34	PsiBlast_CBE		54.93	41%	-119	- C1 -	4BDG	3.7	?
94	PsiBlast_CBE		54.88	40%	-113	- C1 -	3GU4	5.6	DAPK1_HUMAN
53	PsiBlast_CBE		54.79	41%	-119	- C1 -	2YIR	8.7	CHK2_HUMAN
91	PsiBlast_CBE		54.76	40%	-116	- C1 -	3GU7	5.1	DAPK1_HUMAN
104	PsiBlast_CBE		54.72	40%	-137	- C1 -	3ZXT	3.8	DAPK1_HUMAN
57	PsiBlast_CBE		54.70	41%	-120	- C1 -	2W0J	7.7	CHK2_HUMAN
93	PsiBlast_CBE		54.60	40%	-115	- C1 -	3GU5	5.1	DAPK1_HUMAN
37	PsiBlast_CBE		54.51	41%	-124	- C1 -	4BDD	4.5	?
33	PsiBlast_CBE		54.48	41%	-126	- C1 -	4BDH	3.6	?
55	PsiBlast_CBE		54.29	41%	-120	- C1 -	2YCS	6.7	CHK2_HUMAN
50	PsiBlast_CBE		54.29	41%	-122	- C1 -	2CN8	4.9	CHK2_HUMAN
133	HHSearch		54.12	40%	-107	- C1 -	3NYV	5.8	?
31	PsiBlast_CBE		54.11	41%	-122	- C1 -	4BDJ	5.3	?
47	PsiBlast_CBE		54.08	41%	-118	- C1 -	2WTI	6.6	CHK2_HUMAN
39	PsiBlast_CBE		53.92	41%	-123	- C1 -	4BDB	3.4	?
72	PsiBlast_CBE		53.89	42%	-125	- C1 -	3SX9	5.6	?
41	PsiBlast_CBE		53.86	41%	-121	- C1 -	4A9U	6.3	CHK2_HUMAN
89	PsiBlast_CBE		53.73	39%	-106	- C1 -	2W4K	5.4	DAPK1_HUMAN
54	PsiBlast_CBE		53.69	41%	-118	- C1 -	2YIQ	6.9	CHK2_HUMAN
68	PsiBlast_CBE		53.53	42%	-122	- C1 -	3UPX	6.4	?
84	PsiBlast_CBE		53.46	40%	-115	- C1 -	2Y7J	6.1	PHKG2_HUMAN
42	PsiBlast_CBE		53.43	41%	-111	- C1 -	4A9T	6.4	CHK2_HUMAN
97	PsiBlast_CBE		53.37	40%	-114	- C1 -	1P4F	4.9	DAPK1_HUMAN
36	PsiBlast_CBE		53.24	41%	-122	- C1 -	4BDE	4.9	?
20	PsiBlast_PDB		53.21	41%	-112	- C1 -	2YCF	7.7	CHK2_HUMAN
40	PsiBlast_CBE		53.12	41%	-122	- C1 -	4BDA	4.7	?
95	PsiBlast_CBE		52.94	40%	-110	- C1 -	3F5U	5.9	DAPK1_HUMAN
77	PsiBlast_CBE		52.90	42%	-118	- C1 -	3MA6	3.9	?
46	PsiBlast_CBE		52.88	41%	-119	- C1 -	2WTJ	5.0	CHK2_HUMAN
71	PsiBlast_CBE		52.76	42%	-117	- C1 -	3SXF	7.5	?
51	PsiBlast_CBE		52.59	41%	-118	- C1 -	2CN5	6.2	CHK2_HUMAN
35	PsiBlast_CBE		52.45	41%	-120	- C1 -	4BDF	4.6	?
45	PsiBlast_CBE		52.42	41%	-112	- C1 -	2XM9	7.9	CHK2_HUMAN
121	HHSearch		52.28	41%	-96	- C1 -	3SOA	3.6	KCC2A_HUMAN
67	PsiBlast_CBE		52.21	42%	-120	- C1 -	3UPZ	4.3	?
69	PsiBlast_CBE		51.95	42%	-120	- C1 -	3T3V	5.7	?
49	PsiBlast_CBE		51.74	41%	-118	- C1 -	2WTC	6.0	CHK2_HUMAN
136	HHSearch		51.56	38%	-114	- C1 -	3Q5I	4.1	?
70	PsiBlast_CBE		51.27	42%	-121	- C1 -	3T3U	6.2	?
64	PsiBlast_CBE		51.23	42%	-118	- C1 -	3V5T	6.5	?
66	PsiBlast_CBE		51.13	42%	-119	- C1 -	3V51	6.2	?
74	PsiBlast_CBE		50.18	42%	-118	- C1 -	3I7B	6.9	?
65	PsiBlast_CBE		50.04	42%	-120	- C1 -	3V5P	6.0	?
73	PsiBlast_CBE		49.77	42%	-118	- C1 -	3N51	7.1	?
63	PsiBlast_CBE		49.65	42%	-124	- C1 -	3KU2	4.3	?
76	PsiBlast_CBE		49.38	42%	-117	- C1 -	3MA6	5.4	?
124	HHSearch		38.75	34%	-112	- C1 -	3UBD	6.3	KS6A3_MOUSE