Query sequence : spr1393: (2018-01-11 ) MDAKLRYKAKKIKIVFFDIDDTLRNSKTGFIPTTIPTVFKQLREKGILTGIASGRGIFGVVPEIRDLKPDFFVTLNGAYIEDKKGQVIYQHQIEKSYVEEYISWAKQEGIEYGLVGSHDAKLSTRTDMMSEAINPIYPDLDVDPDFHEKEDIYQMWTFEDKGDDLHLPDSLSDKLRMVRWHQHSSDIVPISGSKATGVEKVVEHLGLKPEKVMVFGDGLNDLELFDYAGISVAMGISHDKIKEKADYITKTLEEDGIFDALEVFGMVEKELHFPQVDIETVEGPLATIKTNHGDLRIKLFPEHAPKTVANFVSLSKDGYYDGVIFHRIIKDFMIQGGDPTGTGMGGESIYGESFEDEFSEELYNIRGALSMANAGPNTNGSQFFIVQNQHLPYSKKEITRGGWPEPIAEIYANQGGTPHLDRRHTVFGQLADEASYAVLDVIAAVETGAMDKPVEDVVIETIEIED

Atome Classification :

	(91 SA)										Binding Score for complex ligand / Scwrl (Unconserved SChains Recalculated) model (Only selected ligand are displayed)
			(Atome)	(Ident)	(Tito)	(Num)		(pKd)	(Uniprot)		SFM_D_4(1NMK) PPIA_HUMAN [Raw transfer] EA4_A_2(3RDD) PPIA_HUMAN [Raw transfer] 4ZP_A_6(5CBV) PPIF_HUMAN [Raw transfer] SFM_D_4(1NMK) PPIA_HUMAN [Raw transfer] 78X_A_2(5TA2) PPIA_HUMAN [Raw transfer] 4ZO_A_7(5CBW) PPIF_HUMAN [Raw transfer] 7HG_B_6(5T9U) PPIA_HUMAN [Raw transfer] SFA_D_4(1YND) PPIA_HUMAN [Raw transfer] 7HG_C_7(5T9U) PPIA_HUMAN [Raw transfer] 4ZT_A_8(5CCR) PPIF_HUMAN [Raw transfer] 78R_A_2(5T9Z) PPIA_HUMAN [Raw transfer] 502_A_7(5CCQ) PPIF_HUMAN [Raw transfer] EA4_A_2(4XNC) PPIF_HUMAN [Raw transfer] 7B7_X_2(4J5E) PPIF_HUMAN [Raw transfer] EA4_A_2(4ZSC) PPIF_HUMAN [Raw transfer] EA4_A_2(3RDC) PPIF_HUMAN [Raw transfer] 728_X_2(4J5D) PPIF_HUMAN [Raw transfer] GLY_A_2(4N1M) PPIA_HUMAN [Raw transfer] 7HG_A_5(5T9U) PPIA_HUMAN [Raw transfer] 7HG_D_8(5T9U) PPIA_HUMAN [Raw transfer] 78E_A_2(5T9W) PPIA_HUMAN [Raw transfer] ALA_A_2(2CFE) ? [Raw transfer] 7I6_X_2(4J5C) PPIF_HUMAN [Raw transfer] 838_A_2(5TA4) PPIA_HUMAN [Raw transfer] WM3_A_2(4N1R) PPIA_HUMAN [Raw transfer] 7I6_A_2(4ZSD) PPIF_HUMAN [Raw transfer] GOL_A_3(4R3E) CWC27_HUMAN [Raw transfer] GOL_A_6(3R4G) PPIF_HUMAN [Raw transfer] WM2_A_2(4N1Q) PPIA_HUMAN [Raw transfer] 1P3_A_2(1W8L) PPIA_HUMAN [Raw transfer] 4ZZ_A_7(5CCN) PPIF_HUMAN [Raw transfer] LSA_A_3(4N1O) PPIA_HUMAN [Raw transfer] ALA_B_2(1E8K) CYP3_CAEEL [Raw transfer] GOL_A_2(4DGD) PPIA_MACMU [Raw transfer] GLY_A_2(2IGW) CYP3_CAEEL [Raw transfer] 76X_A_2(5LUD) PPIA_HUMAN [Raw transfer] E1P_A_2(1W8M) PPIA_HUMAN [Raw transfer] FMT_D_4(2POE) ? [Raw transfer] UNU_A_2(4N1N) PPIA_HUMAN [Raw transfer] 6AI_A_3(3R56) PPIF_HUMAN [Raw transfer] DMF_A_2(3RCG) PPIF_HUMAN [Raw transfer] FMT_D_4(2POE) ? [Raw transfer] WM1_A_3(4N1P) PPIA_HUMAN [Raw transfer] M3I_X_4(3RCI) PPIF_HUMAN [Raw transfer] Q8A_A_2(3R49) PPIF_HUMAN [Raw transfer] GOL_A_4(4R3E) CWC27_HUMAN [Raw transfer] EOV_A_3(3EOV) ? [Raw transfer] - 5MZ_A_3(3RDB) PPIF_HUMAN [Raw transfer] EOV_B_4(3EOV) ? [Raw transfer] - GOL_A_4(4R3E) CWC27_HUMAN [Raw transfer] MIO_X_3(3RDA) PPIF_HUMAN [Raw transfer] 3AO_A_2(3R59) PPIF_HUMAN [Raw transfer] 93K_A_2(5NOY) ? [Raw transfer] 5AO_A_2(3RCL) PPIF_HUMAN [Raw transfer] FP6_A_2(3R54) PPIF_HUMAN [Raw transfer] 93E_A_2(5NOQ) ? [Raw transfer] PRO_B_3(1E8K) CYP3_CAEEL [Raw transfer] PRO_A_3(2IGW) CYP3_CAEEL [Raw transfer] ALA_B_3(2QER) ? [Raw transfer] PRO_A_3(4N1M) PPIA_HUMAN [Raw transfer] PRO_A_3(2CFE) ? [Raw transfer] L89_A_2(5NOW) ? [Raw transfer] ACE_B_3(1VDN) CYPH_YEAST [Raw transfer] DTT_A_2(1H0P) CYP5_CAEEL [Raw transfer] L99_A_2(5NOZ) ? [Raw transfer] SER_A_2(2IGV) CYP3_CAEEL [Raw transfer] 92Z_A_2(5NOS) ? [Raw transfer] WM4_A_3(4N1S) PPIA_HUMAN [Raw transfer] L60_A_2(5NOU) ? [Raw transfer] 93Q_A_3(5NOR) ? [Raw transfer] L97_A_2(5NOX) ? [Raw transfer] 93B_A_2(5NOV) ? [Raw transfer] N3M_A_5(3R57) PPIF_HUMAN [Raw transfer] PG5_B_7(3K2C) CYPH_ENCCU [Raw transfer] 938_A_3(5NOT) ? [Raw transfer] BS4_A_3(3RCF) PPIF_HUMAN [Raw transfer] 1FP_X_5(3RCK) PPIF_HUMAN [Raw transfer] SFA_D_4(1YND) PPIA_HUMAN [Raw transfer] MIO_X_5(3RDA) PPIF_HUMAN [Raw transfer] 3EP_A_3(1E3B) CYP3_CAEEL [Raw transfer]
266	HHSearch		79.11	56%	-37	- C1 -	2A2N	-		-
273	HHSearch		77.04	48%	-28	- C1 -	2POE	2.6	?
264	HHSearch		76.54	54%	-2	- C1 -	1W74	-	PPIA_MYCTU	-
261	HHSearch		75.10	51%	-22	- C1 -	2OK3	-	PPIL3_HUMAN	-
19	PsiBlast_PDB		74.88	29%	8	- C2 -	2RB5	-	?	-
13	PsiBlast_PDB		74.87	31%	-25	* C2 *	2PQ0	-	?	-
260	HHSearch		74.82	49%	-42	- C1 -	2X7K	-	PPIL1_HUMAN	-
22	PsiBlast_CBE		74.78	48%	-45	- C1 -	2A2N	-		-
14	PsiBlast_PDB		74.72	31%	-25	- C2 -	2QYH	-	?	-
262	HHSearch		74.52	49%	-37	- C1 -	2B71	-	?	-
20	PsiBlast_PDB		74.32	29%	10	- C2 -	2RBK	-	?	-
18	PsiBlast_PDB		73.95	29%	8	- C2 -	1YMQ	-	?	-
5	PsiBlast_PDB		73.88	48%	-41	- C1 -	2A2N	-	PPWD1_HUMAN	-
265	HHSearch		73.46	46%	-27	- C1 -	1ZKC	-	PPIL2_HUMAN	-
269	HHSearch		73.32	50%	-36	- C1 -	2FU0	-	?	-
2	PsiBlast_PDB		72.75	44%	-34	- C1 -	1XYH	-	PPIL3_HUMAN	-
10	PsiBlast_PDB		72.58	45%	-44	- C1 -	2FU0	-	?	-
11	PsiBlast_PDB		71.88	42%	-32	- C1 -	2POE	2.6	?
274	HHSearch		71.84	41%	-17	- C1 -	4R3E	2.5	CWC27_HUMAN
3	PsiBlast_PDB		71.43	44%	-29	- C1 -	2OK3	-	PPIL3_HUMAN	-
12	PsiBlast_PDB		69.89	42%	-29	- C1 -	2QER	2.7	?
16	PsiBlast_PDB		68.97	37%	-27	- C1 -	4R3E	2.5	CWC27_HUMAN
53	PsiBlast_CBE		60.27	41%	25	- C1 -	1H0P	2.8	CYP5_CAEEL
40	PsiBlast_CBE		58.84	40%	27	- C1 -	1E8K	3.7	CYP3_CAEEL
45	PsiBlast_CBE		58.74	42%	22	- C1 -	3EOV	5.0	?
39	PsiBlast_CBE		58.71	40%	24	- C1 -	2IGV	4.5	CYP3_CAEEL
38	PsiBlast_CBE		58.23	40%	24	- C1 -	2IGW	3.3	CYP3_CAEEL
247	PsiBlast_CBE		58.16	33%	5	- C1 -	5CCR	4.8	PPIF_HUMAN
249	PsiBlast_CBE		57.44	33%	2	- C1 -	5CBV	5.2	PPIF_HUMAN
41	PsiBlast_CBE		57.38	40%	25	- C1 -	1E3B	2.5	CYP3_CAEEL
248	PsiBlast_CBE		57.02	33%	4	- C1 -	5CBW	4.7	PPIF_HUMAN
46	PsiBlast_CBE		56.91	42%	22	- C1 -	3EOV	5.3	?
48	PsiBlast_CBE		54.90	41%	-7	- C1 -	2CFE	3.4	?
67	PsiBlast_CBE		52.65	40%	12	- C1 -	1VDN	2.9	CYPH_YEAST
187	PsiBlast_CBE		52.57	40%	42	- C1 -	3RDD	3.9	PPIA_HUMAN
222	PsiBlast_CBE		52.44	40%	17	- C1 -	3K2C	2.3	CYPH_ENCCU
106	PsiBlast_CBE		51.77	40%	39	- C1 -	5NOT	3.4	?
77	PsiBlast_CBE		51.70	40%	35	- C1 -	4N1M	3.3	PPIA_HUMAN
75	PsiBlast_CBE		51.65	40%	40	- C1 -	5TA2	7.5	PPIA_HUMAN
100	PsiBlast_CBE		51.55	40%	41	- C1 -	5NOZ	3.0	?
112	PsiBlast_CBE		51.49	40%	41	- C1 -	4N1R	3.0	PPIA_HUMAN
78	PsiBlast_CBE		51.47	40%	39	- C1 -	5TA4	7.0	PPIA_HUMAN
111	PsiBlast_CBE		51.42	40%	36	- C1 -	4N1S	3.2	PPIA_HUMAN
116	PsiBlast_CBE		51.20	40%	40	- C1 -	4N1N	3.1	PPIA_HUMAN
107	PsiBlast_CBE		51.00	40%	34	- C1 -	5NOS	2.3	?
108	PsiBlast_CBE		50.93	40%	36	- C1 -	5NOR	2.1	?
103	PsiBlast_CBE		50.82	40%	43	- C1 -	5NOW	2.8	?
168	PsiBlast_CBE		50.79	40%	33	- C1 -	1NMK	8.0	PPIA_HUMAN
102	PsiBlast_CBE		50.75	40%	41	- C1 -	5NOX	3.0	?
79	PsiBlast_CBE		50.63	40%	37	- C1 -	5T9W	6.6	PPIA_HUMAN
114	PsiBlast_CBE		50.58	40%	44	- C1 -	4N1P	2.9	PPIA_HUMAN
76	PsiBlast_CBE		50.58	40%	38	- C1 -	5T9Z	7.1	PPIA_HUMAN
74	PsiBlast_CBE		50.57	40%	38	- C1 -	5T9U	6.5	PPIA_HUMAN
162	PsiBlast_CBE		50.51	40%	36	- C1 -	1YND	2.6	PPIA_HUMAN
164	PsiBlast_CBE		50.44	40%	40	- C1 -	1W8L	3.4	PPIA_HUMAN
109	PsiBlast_CBE		50.40	40%	42	- C1 -	5NOQ	3.0	?
110	PsiBlast_CBE		50.37	40%	46	- C1 -	5LUD	2.5	PPIA_HUMAN
202	PsiBlast_CBE		50.25	39%	30	- C1 -	4DGD	1.9	PPIA_MACMU
104	PsiBlast_CBE		50.02	40%	37	- C1 -	5NOV	2.8	?
163	PsiBlast_CBE		49.98	40%	37	- C1 -	1W8M	3.7	PPIA_HUMAN
169	PsiBlast_CBE		49.96	40%	37	- C1 -	1NMK	Error	PPIA_HUMAN
105	PsiBlast_CBE		49.79	40%	38	- C1 -	5NOU	2.4	?
73	PsiBlast_CBE		49.70	40%	39	- C1 -	5T9U	6.8	PPIA_HUMAN
113	PsiBlast_CBE		49.60	40%	42	- C1 -	4N1Q	3.4	PPIA_HUMAN
101	PsiBlast_CBE		49.53	40%	41	- C1 -	5NOY	2.2	?
161	PsiBlast_CBE		49.21	40%	43	- C1 -	1YND	11.6	PPIA_HUMAN
71	PsiBlast_CBE		49.20	40%	40	- C1 -	5T9U	6.7	PPIA_HUMAN
115	PsiBlast_CBE		48.84	40%	40	- C1 -	4N1O	3.2	PPIA_HUMAN
72	PsiBlast_CBE		47.99	40%	37	- C1 -	5T9U	6.7	PPIA_HUMAN
245	PsiBlast_CBE		45.42	50%	5	- C1 -	4J5D	7.0	PPIF_HUMAN
224	PsiBlast_CBE		44.64	50%	9	- C1 -	3RDC	4.3	PPIF_HUMAN
235	PsiBlast_CBE		43.92	50%	6	- C1 -	3R56	2.5	PPIF_HUMAN
231	PsiBlast_CBE		43.84	50%	10	- C1 -	3RCG	2.4	PPIF_HUMAN
238	PsiBlast_CBE		43.21	50%	13	- C1 -	3R49	2.8	PPIF_HUMAN
230	PsiBlast_CBE		43.21	50%	8	- C1 -	3RCI	2.7	PPIF_HUMAN
229	PsiBlast_CBE		43.04	50%	11	- C1 -	3RCK	2.1	PPIF_HUMAN
243	PsiBlast_CBE		42.78	50%	9	- C1 -	4XNC	4.0	PPIF_HUMAN
244	PsiBlast_CBE		42.47	50%	15	- C1 -	4J5E	6.7	PPIF_HUMAN
241	PsiBlast_CBE		42.33	50%	11	- C1 -	4ZSD	4.6	PPIF_HUMAN
236	PsiBlast_CBE		42.28	50%	5	- C1 -	3R54	2.1	PPIF_HUMAN
232	PsiBlast_CBE		42.26	50%	7	- C1 -	3RCF	3.8	PPIF_HUMAN
225	PsiBlast_CBE		42.26	50%	9	- C1 -	3RDB	3.4	PPIF_HUMAN
228	PsiBlast_CBE		42.25	50%	9	- C1 -	3RCL	2.8	PPIF_HUMAN
237	PsiBlast_CBE		42.24	50%	8	- C1 -	3R4G	2.1	PPIF_HUMAN
246	PsiBlast_CBE		42.18	50%	5	- C1 -	4J5C	7.2	PPIF_HUMAN
234	PsiBlast_CBE		42.18	50%	4	- C1 -	3R57	2.8	PPIF_HUMAN
233	PsiBlast_CBE		42.07	50%	8	- C1 -	3R59	2.7	PPIF_HUMAN
242	PsiBlast_CBE		42.04	50%	11	- C1 -	4ZSC	4.1	PPIF_HUMAN
240	PsiBlast_CBE		41.92	50%	16	- C1 -	5CCN	4.7	PPIF_HUMAN
239	PsiBlast_CBE		41.80	50%	10	- C1 -	5CCQ	3.7	PPIF_HUMAN
226	PsiBlast_CBE		40.83	50%	10	- C1 -	3RDA	3.9	PPIF_HUMAN