Query sequence : CDK9_HUMAN: (2015-10-05 ) MAKQYDSVECPFCDEVSKYEKLAKIGQGTFGEVFKARHRKTGQKVALKKVLMENEKEGFPITALREIKILQLLKHENVVNLIEICRTKASPYNRCKGSIYLVFDFCEHDLAGLLSNVLVKFTLSEIKRVMQMLLNGLYYIHRNKILHRDMKAANVLITRDGVLKLADFGLARAFSLAKNSQPNRYTNRVVTLWYRPPELLLGERDYGPPIDLWGAGCIMAEMWTRSPIMQGNTEQHQLALISQLCGSITPEVWPNVDNYELYEKLELVKGQKRKVKDRLKAYVRDPYALDLIDKLLVLDPAQRIDSDDALNHDFFWSDPMPSDLKGMLSTHLTSMFEYLAPPRRKGSQITQQSTNQSRNPATTNQTEFERVF

Atome Classification :

	(97 SA)										Binding Score for complex ligand / Scwrl (Unconserved SChains Recalculated) model (Only selected ligand are displayed)
			(Atome)	(Ident)	(Tito)	(Num)		(pKd)	(Uniprot)		T3C_A_3(4BCG) CDK9_HUMAN [Raw transfer] ATP_A_4(3BLQ) CDK9_HUMAN [Raw transfer] ADP_A_5(4NST) CDK12_HUMAN [Raw transfer] ANP_A_5(4CXA) CDK12_HUMAN [Raw transfer] ANP_A_7(1CM8) MK12_HUMAN [Raw transfer] SBC_A_7(2BKZ) CDK2_HUMAN [Raw transfer] ADP_A_5(4NST) CDK12_HUMAN [Raw transfer] 38R_A_3(4BGQ) CDKL5_HUMAN [Raw transfer] ADP_A_4(3NIZ) ? [Raw transfer] SBC_C_8(2BKZ) CDK2_HUMAN [Raw transfer] WXV_C_6(2WXV) CDK2_HUMAN [Raw transfer] ANP_A_4(3MIA) CDK9_HUMAN [Raw transfer] ATP_E_5(1UA2) CDK7_HUMAN [Raw transfer] 3O0_B_5(3O0G) CDK5_HUMAN [Raw transfer] T9N_A_3(4BCJ) CDK9_HUMAN [Raw transfer] P48_A_5(2WIH) CDK2_HUMAN [Raw transfer] WXV_A_5(2WXV) CDK2_HUMAN [Raw transfer] F18_A_3(3TNH) CDK9_HUMAN [Raw transfer] P48_C_6(2WIH) CDK2_HUMAN [Raw transfer] Z14_A_3(3R83) CDK2_HUMAN [Raw transfer] INR_B_4(1V0O) CDC2H_PLAFK [Raw transfer] Z62_A_2(3R8V) CDK2_HUMAN [Raw transfer] P49_A_5(2WIP) CDK2_HUMAN [Raw transfer] P49_C_6(2WIP) CDK2_HUMAN [Raw transfer] SLQ_A_3(3LQ5) CDK9_HUMAN [Raw transfer] T3E_A_3(4BCI) CDK9_HUMAN [Raw transfer] 08Z_A_3(3RK7) CDK2_HUMAN [Raw transfer] 07Z_A_2(3RK5) CDK2_HUMAN [Raw transfer] 04Z_A_2(3RAL) CDK2_HUMAN [Raw transfer] 99Z_A_3(3SQQ) CDK2_HUMAN [Raw transfer] PVB_B_4(1V0P) CDC2H_PLAFK [Raw transfer] 889_A_6(2WPA) CDK2_HUMAN [Raw transfer] 03Z_A_2(3RAK) CDK2_HUMAN [Raw transfer] X64_A_6(4GCJ) CDK2_HUMAN [Raw transfer] 56Z_A_2(3S1H) CDK2_HUMAN [Raw transfer] PVB_A_3(1V0P) CDC2H_PLAFK [Raw transfer] 20Z_A_2(3RMF) CDK2_HUMAN [Raw transfer] X85_A_3(3RAI) CDK2_HUMAN [Raw transfer] Z31_A_2(3R8U) CDK2_HUMAN [Raw transfer] 889_C_7(2WPA) CDK2_HUMAN [Raw transfer] RRC_A_5(1UNL) CDK5_HUMAN [Raw transfer] 27Z_A_2(3RPY) CDK2_HUMAN [Raw transfer] X6B_A_2(3R9D) CDK2_HUMAN [Raw transfer] 26Z_A_3(3RPV) CDK2_HUMAN [Raw transfer] Z68_A_2(3R9N) CDK2_HUMAN [Raw transfer] 514_C_8(2C4G) CDK2_HUMAN [Raw transfer] Z67_A_2(3R9H) CDK2_HUMAN [Raw transfer] 514_A_7(2C4G) CDK2_HUMAN [Raw transfer] O1Z_A_2(3RAH) CDK2_HUMAN [Raw transfer] Z71_A_2(3R9O) CDK2_HUMAN [Raw transfer] 02Z_A_2(3RZB) CDK2_HUMAN [Raw transfer] INR_A_3(1V0O) CDC2H_PLAFK [Raw transfer] X86_A_3(3R71) CDK2_HUMAN [Raw transfer] Z63_A_2(3R8Z) CDK2_HUMAN [Raw transfer] 24Z_A_3(3RPO) CDK2_HUMAN [Raw transfer] 06Z_A_2(3RJC) CDK2_HUMAN [Raw transfer] 09Z_A_2(3RK9) CDK2_HUMAN [Raw transfer] ALH_A_5(1UNG) CDK5_HUMAN [Raw transfer] 529_C_8(2BPM) CDK2_HUMAN [Raw transfer] Z30_A_2(3R8L) CDK2_HUMAN [Raw transfer] 292_A_7(1VYW) CDK2_HUMAN [Raw transfer] 292_C_8(1VYW) CDK2_HUMAN [Raw transfer] CPB_A_6(3BLR) CDK9_HUMAN [Raw transfer] STU_A_2(4EZ7) CDK2_HUMAN [Raw transfer] 25Z_A_2(3RPR) CDK2_HUMAN [Raw transfer] 529_A_7(2BPM) CDK2_HUMAN [Raw transfer] Z04_A_3(3R7Y) CDK2_HUMAN [Raw transfer] Z46_A_2(3R8P) CDK2_HUMAN [Raw transfer] X87_A_3(3R73) CDK2_HUMAN [Raw transfer] Z19_A_3(3R8M) CDK2_HUMAN [Raw transfer] Z3R_B_10(4AU8) CDK5_HUMAN [Raw transfer] 21Z_A_2(3RNI) CDK2_HUMAN [Raw transfer] 12Z_A_3(3RKB) CDK2_HUMAN [Raw transfer] 50Z_A_2(3S0O) CDK2_HUMAN [Raw transfer] Z3R_A_6(4AU8) CDK5_HUMAN [Raw transfer] 19Z_A_3(3RM7) CDK2_HUMAN [Raw transfer] Z60_A_2(3S00) CDK2_HUMAN [Raw transfer] Z02_A_3(3R7V) CDK2_HUMAN [Raw transfer] Z3R_A_6(4AU8) CDK5_HUMAN [Raw transfer] X72_A_3(3QZI) CDK2_HUMAN [Raw transfer] LZ9_A_4(4Y72) ? [Raw transfer] X69_A_3(3QZH) CDK2_HUMAN [Raw transfer] X84_A_3(3R6X) CDK2_HUMAN [Raw transfer] 18Z_A_3(3RM6) CDK2_HUMAN [Raw transfer] X88_A_3(3R7E) CDK2_HUMAN [Raw transfer] 22Z_A_3(3ROY) CDK2_HUMAN [Raw transfer] X75_A_3(3R1Q) CDK2_HUMAN [Raw transfer] X73_A_3(3R1S) CDK2_HUMAN [Raw transfer] X76_A_3(3R1Y) CDK2_HUMAN [Raw transfer] X96_A_3(3R7U) CDK2_HUMAN [Raw transfer] 0S0_A_2(4EZ3) CDK2_HUMAN [Raw transfer] RFZ_A_5(3MY1) CDK9_HUMAN [Raw transfer] XA0_A_3(3R28) CDK2_HUMAN [Raw transfer] 0SR_A_3(4F6U) CDK8_HUMAN [Raw transfer] X9I_A_3(3R7I) CDK2_HUMAN [Raw transfer] 2AN_A_3(4EZ7) CDK2_HUMAN [Raw transfer] 1CK_A_2(4EK4) CDK2_HUMAN [Raw transfer] EDO_A_3(4EZ3) CDK2_HUMAN [Raw transfer] AF3_A_6(4NST) CDK12_HUMAN [Raw transfer] AF3_A_6(4NST) CDK12_HUMAN [Raw transfer]
13	PsiBlast_PDB		95.61	99%	-131	- C1 -	4BCG	6.4	CDK9_HUMAN
5	PsiBlast_PDB		94.65	99%	-136	- C1 -	3BLQ	4.0	CDK9_HUMAN
4	PsiBlast_PDB		93.63	99%	-125	- C1 -	3MIA	3.8	CDK9_HUMAN
9	PsiBlast_PDB		92.40	99%	-136	- C1 -	3TNH	4.4	CDK9_HUMAN
11	PsiBlast_PDB		91.85	99%	-127	- C1 -	4BCI	5.8	CDK9_HUMAN
6	PsiBlast_PDB		91.84	99%	-128	- C1 -	3BLR	7.5	CDK9_HUMAN
7	PsiBlast_PDB		91.60	99%	-123	- C1 -	3MY1	4.9	CDK9_HUMAN
12	PsiBlast_PDB		91.17	99%	-126	- C1 -	4BCJ	5.6	CDK9_HUMAN
8	PsiBlast_PDB		91.05	99%	-129	- C1 -	3LQ5	6.9	CDK9_HUMAN
115	HHSearch		71.23	48%	-117	- C1 -	4NST	4.7	CDK12_HUMAN
15	PsiBlast_PDB		70.92	45%	-110	- C1 -	4CXA	5.2	CDK12_HUMAN
16	PsiBlast_PDB		69.26	45%	-111	- C1 -	4NST	5.1	CDK12_HUMAN
31	PsiBlast_CBE		67.79	40%	-118	- C1 -	1V0P	8.0	CDC2H_PLAFK
19	PsiBlast_PDB		65.73	40%	-119	- C1 -	3NIZ	4.2	?
89	PsiBlast_CBE		65.04	39%	-111	- C1 -	3R83	5.4	CDK2_HUMAN
78	PsiBlast_CBE		64.73	39%	-112	- C1 -	3RAH	6.5	CDK2_HUMAN
24	PsiBlast_CBE		64.35	41%	-115	- C1 -	4Y72	6.3	?
96	PsiBlast_CBE		64.32	39%	-111	- C1 -	3R71	5.3	CDK2_HUMAN
93	PsiBlast_CBE		64.32	39%	-112	- C1 -	3R7I	4.9	CDK2_HUMAN
83	PsiBlast_CBE		64.26	39%	-114	- C1 -	3R8Z	4.2	CDK2_HUMAN
64	PsiBlast_CBE		64.22	39%	-111	- C1 -	3RPO	5.3	CDK2_HUMAN
86	PsiBlast_CBE		64.11	39%	-112	- C1 -	3R8P	3.9	CDK2_HUMAN
80	PsiBlast_CBE		64.03	39%	-111	- C1 -	3R9N	5.7	CDK2_HUMAN
133	HHSearch		63.99	41%	-109	- C1 -	4AU8	4.9	CDK5_HUMAN
63	PsiBlast_CBE		63.75	39%	-112	- C1 -	3RPR	6.9	CDK2_HUMAN
28	PsiBlast_CBE		63.75	40%	-118	- C1 -	1V0O	6.4	CDC2H_PLAFK
59	PsiBlast_CBE		63.68	39%	-110	- C1 -	3S00	4.5	CDK2_HUMAN
92	PsiBlast_CBE		63.65	39%	-111	- C1 -	3R7U	5.1	CDK2_HUMAN
116	HHSearch		63.59	41%	-99	- C1 -	1UA2	5.2	CDK7_HUMAN
25	PsiBlast_CBE		63.52	41%	-112	- C1 -	4AU8	4.9	CDK5_HUMAN
90	PsiBlast_CBE		63.50	39%	-112	- C1 -	3R7Y	5.3	CDK2_HUMAN
77	PsiBlast_CBE		63.38	39%	-110	- C1 -	3RAI	5.2	CDK2_HUMAN
29	PsiBlast_CBE		63.37	40%	-115	- C1 -	1V0O	6.0	CDC2H_PLAFK
101	PsiBlast_CBE		63.24	39%	-109	- C1 -	3R1Q	5.5	CDK2_HUMAN
94	PsiBlast_CBE		63.24	39%	-112	- C1 -	3R7E	4.4	CDK2_HUMAN
103	PsiBlast_CBE		63.19	39%	-109	- C1 -	3QZH	4.7	CDK2_HUMAN
58	PsiBlast_CBE		63.15	39%	-112	- C1 -	3S0O	4.7	CDK2_HUMAN
49	PsiBlast_CBE		63.11	40%	-112	- C1 -	1UNL	7.2	CDK5_HUMAN
102	PsiBlast_CBE		62.99	39%	-110	- C1 -	3QZI	5.3	CDK2_HUMAN
99	PsiBlast_CBE		62.85	39%	-110	- C1 -	3R1Y	4.3	CDK2_HUMAN
52	PsiBlast_CBE		62.83	40%	-117	- C1 -	1UNG	5.1	CDK5_HUMAN
100	PsiBlast_CBE		62.80	39%	-109	- C1 -	3R1S	5.0	CDK2_HUMAN
85	PsiBlast_CBE		62.78	39%	-108	- C1 -	3R8U	5.5	CDK2_HUMAN
84	PsiBlast_CBE		62.78	39%	-111	- C1 -	3R8V	5.4	CDK2_HUMAN
68	PsiBlast_CBE		62.75	39%	-113	- C1 -	3RM7	5.1	CDK2_HUMAN
56	PsiBlast_CBE		62.71	39%	-106	- C1 -	3SQQ	5.9	CDK2_HUMAN
97	PsiBlast_CBE		62.63	39%	-108	- C1 -	3R6X	5.4	CDK2_HUMAN
55	PsiBlast_CBE		62.52	39%	-110	- C1 -	4EZ3	4.3	CDK2_HUMAN
91	PsiBlast_CBE		62.50	39%	-109	- C1 -	3R7V	4.6	CDK2_HUMAN
98	PsiBlast_CBE		62.48	39%	-109	- C1 -	3R28	5.8	CDK2_HUMAN
88	PsiBlast_CBE		62.24	39%	-111	- C1 -	3R8L	4.6	CDK2_HUMAN
95	PsiBlast_CBE		62.16	39%	-110	- C1 -	3R73	5.8	CDK2_HUMAN
44	PsiBlast_CBE		62.13	39%	-103	- C1 -	2BKZ	4.9	CDK2_HUMAN
65	PsiBlast_CBE		62.08	39%	-108	- C1 -	3ROY	5.5	CDK2_HUMAN
48	PsiBlast_CBE		62.08	40%	-118	- C1 -	3O0G	6.4	CDK5_HUMAN
79	PsiBlast_CBE		62.07	39%	-109	- C1 -	3R9O	5.6	CDK2_HUMAN
87	PsiBlast_CBE		62.01	39%	-106	- C1 -	3R8M	3.7	CDK2_HUMAN
81	PsiBlast_CBE		61.85	39%	-112	- C1 -	3R9H	5.2	CDK2_HUMAN
82	PsiBlast_CBE		61.78	39%	-106	- C1 -	3R9D	5.7	CDK2_HUMAN
30	PsiBlast_CBE		61.74	40%	-123	- C1 -	1V0P	7.1	CDC2H_PLAFK
76	PsiBlast_CBE		61.68	39%	-111	- C1 -	3RAK	5.9	CDK2_HUMAN
62	PsiBlast_CBE		61.68	39%	-109	- C1 -	3RPV	6.0	CDK2_HUMAN
74	PsiBlast_CBE		61.67	39%	-113	- C1 -	3RJC	5.9	CDK2_HUMAN
57	PsiBlast_CBE		61.47	39%	-111	- C1 -	3S1H	6.1	CDK2_HUMAN
67	PsiBlast_CBE		61.41	39%	-111	- C1 -	3RMF	7.3	CDK2_HUMAN
26	PsiBlast_CBE		61.35	41%	-106	- C1 -	4AU8	4.9	CDK5_HUMAN
123	HHSearch		61.29	36%	-113	- C1 -	4F6U	9.1	CDK8_HUMAN
53	PsiBlast_CBE		61.09	39%	-107	- C1 -	4GCJ	5.7	CDK2_HUMAN
61	PsiBlast_CBE		61.04	39%	-112	- C1 -	3RPY	4.0	CDK2_HUMAN
42	PsiBlast_CBE		60.95	39%	-105	- C1 -	2BPM	5.8	CDK2_HUMAN
60	PsiBlast_CBE		60.90	39%	-112	- C1 -	3RZB	4.5	CDK2_HUMAN
73	PsiBlast_CBE		60.89	39%	-110	- C1 -	3RK5	5.6	CDK2_HUMAN
71	PsiBlast_CBE		60.87	39%	-108	- C1 -	3RK9	4.9	CDK2_HUMAN
47	PsiBlast_CBE		60.86	39%	-102	- C1 -	1VYW	6.7	CDK2_HUMAN
36	PsiBlast_CBE		60.81	39%	-107	- C1 -	2WIP	7.3	CDK2_HUMAN
66	PsiBlast_CBE		60.79	39%	-106	- C1 -	3RNI	5.1	CDK2_HUMAN
37	PsiBlast_CBE		60.74	39%	-106	- C1 -	2WIP	7.3	CDK2_HUMAN
75	PsiBlast_CBE		60.67	39%	-111	- C1 -	3RAL	6.2	CDK2_HUMAN
43	PsiBlast_CBE		60.65	39%	-101	- C1 -	2BPM	5.9	CDK2_HUMAN
45	PsiBlast_CBE		60.60	39%	-102	- C1 -	2BKZ	5.3	CDK2_HUMAN
32	PsiBlast_CBE		60.59	39%	-105	- C1 -	2WXV	7.1	CDK2_HUMAN
70	PsiBlast_CBE		60.55	39%	-110	- C1 -	3RKB	4.9	CDK2_HUMAN
41	PsiBlast_CBE		60.53	39%	-101	- C1 -	2C4G	5.6	CDK2_HUMAN
72	PsiBlast_CBE		60.52	39%	-110	- C1 -	3RK7	5.8	CDK2_HUMAN
40	PsiBlast_CBE		60.33	39%	-104	- C1 -	2C4G	5.5	CDK2_HUMAN
35	PsiBlast_CBE		60.29	39%	-101	- C1 -	2WPA	6.2	CDK2_HUMAN
39	PsiBlast_CBE		60.24	39%	-101	- C1 -	2WIH	8.8	CDK2_HUMAN
34	PsiBlast_CBE		60.11	39%	-105	- C1 -	2WPA	6.1	CDK2_HUMAN
69	PsiBlast_CBE		59.99	39%	-103	- C1 -	3RM6	5.7	CDK2_HUMAN
46	PsiBlast_CBE		59.79	39%	-107	- C1 -	1VYW	6.4	CDK2_HUMAN
54	PsiBlast_CBE		59.50	39%	-100	- C1 -	4EZ7	8.9	CDK2_HUMAN
38	PsiBlast_CBE		59.27	39%	-106	- C1 -	2WIH	8.3	CDK2_HUMAN
33	PsiBlast_CBE		59.23	39%	-101	- C1 -	2WXV	7.8	CDK2_HUMAN
127	HHSearch		58.28	36%	-114	- C1 -	4BGQ	7.5	CDKL5_HUMAN
125	HHSearch		55.35	35%	-110	- C1 -	1CM8	5.0	MK12_HUMAN
128	HHSearch		49.55	33%	-110	- C1 -	2FST	-	MK14_HUMAN
129	HHSearch		20.28	41%	11	* C1 *	4EK4	3.2	CDK2_HUMAN