Query sequence : B0VKK3: (2017-10-26 ) MKTETTIQGLAASLNPARAARKIIGFVPTMGNLHEGHLTLVREAKKLCDVVVVSIFVNPTQFGPGEDFDNYPRTLEQDSRLLADVGCDIIFAPSVEQMYGTQPRLTNISVSQITDDLCGSSRPGHFDGVALVVTKLFNIVQPNYAFFGQKDYQQLAVIRQFVQDLNIPLEVIGVPIVRAEDGLALSSRNGYLTPEQRQVAPVIYQGLKQAEEQLHQGKDLQQVLADLKTLLTDNGFVVDYVEARQPNLLAASQFDRDIVLFVAAKLGGTRLIDNLQVAFTPQ

Atome Classification :

	(114 SA)										Binding Score for complex ligand / Scwrl (Unconserved SChains Recalculated) model (Only selected ligand are displayed)
			(Atome)	(Ident)	(Tito)	(Num)		(pKd)	(Uniprot)		PAJ_A_3(3AG6) PANC_STAA8 [Raw transfer] PAJ_B_9(3AG6) PANC_STAA8 [Raw transfer] PAJ_B_9(3AG6) PANC_STAA8 [Raw transfer] ATP_C_9(3INN) PANC_BRUME [Raw transfer] ATP_C_9(3INN) PANC_BRUME [Raw transfer] ATP_A_5(3INN) PANC_BRUME [Raw transfer] ATP_D_13(3INN) PANC_BRUME [Raw transfer] 52H_A_3(3COW) PANC_MYCTU [Raw transfer] 52H_B_4(3COW) PANC_MYCTU [Raw transfer] APC_B_5(2X3F) PANC_STAAR [Raw transfer] ANP_A_3(5UCR) ? [Raw transfer] PAF_D_10(3Q12) PANC_YERPE [Raw transfer] PAF_B_5(3GUZ) PANC_ECOLI [Raw transfer] PAF_C_8(3Q12) PANC_YERPE [Raw transfer] A7D_B_9(3IOE) PANC_MYCTU [Raw transfer] 54H_A_5(3COZ) PANC_MYCTU [Raw transfer] ANP_A_3(5UCR) ? [Raw transfer] ATP_A_3(4G5Y) PANC_MYCTU [Raw transfer] ATP_B_9(4G5Y) PANC_MYCTU [Raw transfer] PAF_B_7(3Q12) PANC_YERPE [Raw transfer] PAF_B_7(3Q12) PANC_YERPE [Raw transfer] A7D_A_3(3IOE) PANC_MYCTU [Raw transfer] AMP_A_5(3Q10) PANC_YERPE [Raw transfer] EDO_A_11(3IUE) PANC_MYCTU [Raw transfer] PAF_A_5(3Q12) PANC_YERPE [Raw transfer] ANP_A_3(5KWV) ? [Raw transfer] GOL_A_9(1UFV) PANC_THET8 [Raw transfer] 53H_B_4(3COY) PANC_MYCTU [Raw transfer] AMP_B_9(3Q10) PANC_YERPE [Raw transfer] 2DJ_A_5(4MUF) PANC_MYCTO [Raw transfer] GOL_A_5(3MUE) PANC_SALTY [Raw transfer] APC_A_3(2X3F) PANC_STAAR [Raw transfer] AMP_C_12(3Q10) PANC_YERPE [Raw transfer] GOL_B_14(3COV) PANC_MYCTU [Raw transfer] GOL_B_14(3COV) PANC_MYCTU [Raw transfer] GOL_B_10(1V8F) PANC_THET8 [Raw transfer] 2DU_A_6(4MUJ) PANC_MYCTO [Raw transfer] GOL_C_22(3MUE) PANC_SALTY [Raw transfer] ANP_B_4(5KWV) ? [Raw transfer] GOL_B_10(1V8F) PANC_THET8 [Raw transfer] GOL_B_14(3MUE) PANC_SALTY [Raw transfer] FMT_A_5(3MXT) PANC_CAMJE [Raw transfer] GOL_A_6(3MXT) PANC_CAMJE [Raw transfer] AMP_A_3(3UK2) PANC_BURTA [Raw transfer] GOL_A_6(3MXT) PANC_CAMJE [Raw transfer] 2DQ_A_7(4MUI) PANC_MYCTO [Raw transfer] GOL_A_3(3IVG) PANC_MYCTU [Raw transfer] FG6_B_14(3IVX) PANC_MYCTU [Raw transfer] ANP_B_6(5UCR) ? [Raw transfer] AMP_A_2(3UY4) PANC_CAMJE [Raw transfer] EDO_A_4(1IHO) PANC_ECOLI [Raw transfer] A5D_A_5(3IOC) PANC_MYCTU [Raw transfer] A6D_B_9(3IOD) PANC_MYCTU [Raw transfer] GOL_A_6(1UFV) PANC_THET8 [Raw transfer] 2DQ_B_10(4MUI) PANC_MYCTO [Raw transfer] EDO_A_9(4FZJ) PANC_MYCTU [Raw transfer] EDO_B_5(1IHO) PANC_ECOLI [Raw transfer] AMP_B_10(3UK2) PANC_BURTA [Raw transfer] EDO_B_5(1IHO) PANC_ECOLI [Raw transfer] GOL_A_7(3COV) PANC_MYCTU [Raw transfer] AMP_B_10(3UK2) PANC_BURTA [Raw transfer] FG6_A_3(3IVX) PANC_MYCTU [Raw transfer] FG5_B_16(3IVG) PANC_MYCTU [Raw transfer] A6D_A_3(3IOD) PANC_MYCTU [Raw transfer] FMT_A_9(3MXT) PANC_CAMJE [Raw transfer] AMP_A_5(3N8H) PANC_FRATT [Raw transfer] 2DW_B_13(4MUL) PANC_MYCTO [Raw transfer] A5D_B_6(3IOC) PANC_MYCTU [Raw transfer] AMP_D_14(3Q10) PANC_YERPE [Raw transfer] 0JD_A_3(4DE5) PANC_MYCTU [Raw transfer] BZ2_A_3(3IMG) PANC_MYCTU [Raw transfer] BZ2_A_3(3IME) PANC_MYCTU [Raw transfer] 2DV_A_3(4MUK) PANC_MYCTO [Raw transfer] 0JD_B_8(4DE5) PANC_MYCTU [Raw transfer] 2DU_B_11(4MUJ) PANC_MYCTO [Raw transfer] 2B5_B_11(3LE8) PANC_MYCTU [Raw transfer] 2DW_A_6(4MUL) PANC_MYCTO [Raw transfer] FG4_A_3(3IVC) PANC_MYCTU [Raw transfer] 2DN_B_11(4MUH) PANC_MYCTO [Raw transfer] FG4_B_11(3IVC) PANC_MYCTU [Raw transfer] 2DJ_B_6(4MUF) PANC_MYCTO [Raw transfer] BZ2_B_8(3IME) PANC_MYCTU [Raw transfer] 144_A_8(1V8F) PANC_THET8 [Raw transfer] BZ2_B_10(3IMG) PANC_MYCTU [Raw transfer] FG4_A_3(3IVC) PANC_MYCTU [Raw transfer] FG3_B_18(3IUE) PANC_MYCTU [Raw transfer] 2DK_A_7(4MUG) PANC_MYCTO [Raw transfer] A8D_B_15(3ISJ) PANC_MYCTU [Raw transfer] FG2_B_19(3IUB) PANC_MYCTU [Raw transfer] 2DV_B_12(4MUK) PANC_MYCTO [Raw transfer] ALA_B_7(5UCR) ? [Raw transfer] FG2_A_10(3IUB) PANC_MYCTU [Raw transfer] 2DK_B_11(4MUG) PANC_MYCTO [Raw transfer] 2DZ_A_7(4MUN) PANC_MYCTO [Raw transfer] 2DN_A_5(4MUH) PANC_MYCTO [Raw transfer] FG3_A_3(3IUE) PANC_MYCTU [Raw transfer] A4D_B_10(3IOB) PANC_MYCTU [Raw transfer] 2DZ_B_15(4MUN) PANC_MYCTO [Raw transfer] 0HO_A_8(4DDM) PANC_MYCTU [Raw transfer] 0HO_B_9(4DDM) PANC_MYCTU [Raw transfer] 2DH_B_7(4MUE) PANC_MYCTO [Raw transfer] A4D_A_3(3IOB) PANC_MYCTU [Raw transfer] ALA_A_4(5UCR) ? [Raw transfer] 2DH_A_3(4MUE) PANC_MYCTO [Raw transfer] ACY_A_4(3AG6) PANC_STAA8 [Raw transfer] 0OC_A_3(4EFK) PANC_MYCTU [Raw transfer] 0OC_B_10(4EFK) PANC_MYCTU [Raw transfer] ACY_B_10(3AG6) PANC_STAA8 [Raw transfer] 0HN_A_3(4DDK) PANC_MYCTU [Raw transfer] 0HN_B_7(4DDK) PANC_MYCTU [Raw transfer] 0W1_B_12(4FZJ) PANC_MYCTU [Raw transfer] I2E_A_6(4EF6) PANC_MYCTU [Raw transfer] TRS_A_3(1IHO) PANC_ECOLI [Raw transfer] I2E_B_17(4EF6) PANC_MYCTU [Raw transfer] MS0_A_5(4DDH) PANC_MYCTU [Raw transfer] MS0_B_9(4DDH) PANC_MYCTU [Raw transfer] BZ3_A_3(3IMC) PANC_MYCTU [Raw transfer] BZ3_B_11(3IMC) PANC_MYCTU [Raw transfer] PAF_A_4(3GUZ) PANC_ECOLI [Raw transfer]
113	HHSearch		86.11	43%	-99	- C8 -	3MXT	2.1	PANC_CAMJE
116	HHSearch		86.04	50%	-97	- C8 -	2EJC	-	PANC_THEMA	-
15	PsiBlast_PDB		85.79	43%	-102	- C8 -	3UY4	6.7	PANC_CAMJE
16	PsiBlast_PDB		85.44	44%	-96	- C8 -	3UK2	6.5	PANC_BURTA
14	PsiBlast_PDB		85.34	43%	-101	- C8 -	3MXT	3.4	PANC_CAMJE
114	HHSearch		84.63	46%	-103	- C8 -	3INN	8.5	PANC_BRUME
38	PsiBlast_CBE		84.03	44%	-96	- C8 -	3UK2	6.6	PANC_BURTA
29	PsiBlast_CBE		83.73	47%	-106	- C8 -	3INN	8.5	PANC_BRUME
7	PsiBlast_PDB		83.68	47%	-105	- C8 -	3INN	7.6	PANC_BRUME
28	PsiBlast_CBE		82.99	47%	-116	- C8 -	3INN	7.6	PANC_BRUME
115	HHSearch		82.86	45%	-62	- C8 -	3Q12	2.8	PANC_YERPE
30	PsiBlast_CBE		82.63	44%	-104	- C8 -	2X3F	8.6	PANC_STAAR
8	PsiBlast_PDB		82.49	44%	-99	- C8 -	2X3F	7.5	PANC_STAAR
1	PsiBlast_PDB		82.45	50%	-50	- C8 -	2EJC	-	PANC_THEMA	-
118	HHSearch		82.35	50%	-97	- C8 -	5UCR	9.4	?
123	HHSearch		82.21	49%	-64	- C8 -	1V8F	2.7	PANC_THET8
101	Fugue		82.20	47%	-62	- C8 -	1IHO	1.9	PANC_ECOLI
111	HHSearch		82.19	43%	-100	- C8 -	3AG6	9.2	PANC_STAA8
112	HHSearch		81.28	47%	-64	- C8 -	1IHO	2.4	PANC_ECOLI
9	PsiBlast_PDB		80.90	44%	-122	- C8 -	3AG5	-	PANC_STAA8	-
10	PsiBlast_PDB		80.57	44%	-105	- C8 -	3AG6	9.1	PANC_STAA8
24	PsiBlast_CBE		80.22	48%	-67	- C8 -	1V8F	2.7	PANC_THET8
5	PsiBlast_PDB		79.94	48%	-69	- C8 -	1V8F	2.3	PANC_THET8
120	HHSearch		79.74	43%	-68	- C8 -	3IVC	7.1	PANC_MYCTU
32	PsiBlast_CBE		79.69	47%	-57	- C8 -	3Q12	2.8	PANC_YERPE
117	HHSearch		79.59	45%	-54	- C8 -	3UK2	6.6	PANC_BURTA
6	PsiBlast_PDB		79.57	47%	-42	- C8 -	3MUE	3.0	PANC_SALTY
36	PsiBlast_CBE		79.50	47%	-51	- C8 -	3Q10	6.0	PANC_YERPE
11	PsiBlast_PDB		79.28	47%	-62	- C8 -	1UFV	3.2	PANC_THET8
31	PsiBlast_CBE		79.13	44%	-103	- C8 -	3AG6	9.2	PANC_STAA8
34	PsiBlast_CBE		78.83	47%	-49	- C8 -	3Q12	2.8	PANC_YERPE
119	HHSearch		78.80	43%	-68	* C8 *	3COV	2.6	PANC_MYCTU
23	PsiBlast_CBE		78.80	49%	-39	- C8 -	1IHO	2.4	PANC_ECOLI
26	PsiBlast_CBE		78.73	47%	-44	- C8 -	3MUE	3.3	PANC_SALTY
33	PsiBlast_CBE		78.51	47%	-47	- C8 -	3Q12	2.7	PANC_YERPE
4	PsiBlast_PDB		78.37	49%	-39	- C8 -	1IHO	3.2	PANC_ECOLI
21	PsiBlast_CBE		78.29	52%	-97	- C8 -	5KWV	6.3	?
3	PsiBlast_PDB		78.25	52%	-99	- C8 -	5UCR	9.4	?
37	PsiBlast_CBE		78.08	47%	-46	- C8 -	3Q10	6.5	PANC_YERPE
13	PsiBlast_PDB		77.88	47%	-44	- C8 -	3Q12	2.7	PANC_YERPE
2	PsiBlast_PDB		77.69	52%	-95	- C8 -	5KWV	7.6	?
12	PsiBlast_PDB		77.62	47%	-43	- C8 -	3Q10	6.6	PANC_YERPE
22	PsiBlast_CBE		77.01	52%	-97	- C8 -	5UCR	6.3	?
27	PsiBlast_CBE		76.19	47%	-35	- C8 -	3MUE	2.9	PANC_SALTY
60	PsiBlast_CBE		72.86	45%	-50	- C8 -	3IUB	6.4	PANC_MYCTU
98	PsiBlast_CBE		72.72	45%	-51	- C8 -	4EF6	4.8	PANC_MYCTU
44	PsiBlast_CBE		72.63	45%	-50	- C8 -	4DE5	3.9	PANC_MYCTU
42	PsiBlast_CBE		72.44	45%	-51	- C8 -	4FZJ	2.2	PANC_MYCTU
40	PsiBlast_CBE		72.31	45%	-45	- C8 -	4G5Y	9.1	PANC_MYCTU
68	PsiBlast_CBE		72.27	45%	-50	- C8 -	3IOB	6.2	PANC_MYCTU
20	PsiBlast_PDB		72.22	45%	-53	- C8 -	3IMC	4.5	PANC_MYCTU
18	PsiBlast_PDB		72.08	45%	-52	- C8 -	3COW	9.8	PANC_MYCTU
17	PsiBlast_PDB		71.92	45%	-52	- C8 -	3COV	2.4	PANC_MYCTU
70	PsiBlast_CBE		71.91	45%	-50	- C8 -	3IMG	3.2	PANC_MYCTU
80	PsiBlast_CBE		71.85	45%	-49	- C8 -	4MUL	8.7	PANC_MYCTO
46	PsiBlast_CBE		71.80	45%	-44	- C8 -	4DDM	2.8	PANC_MYCTU
62	PsiBlast_CBE		71.77	45%	-47	- C8 -	3IOE	7.6	PANC_MYCTU
84	PsiBlast_CBE		71.76	45%	-46	- C8 -	4MUJ	8.7	PANC_MYCTO
78	PsiBlast_CBE		71.73	45%	-50	- C8 -	4MUN	5.0	PANC_MYCTO
52	PsiBlast_CBE		71.56	45%	-50	- C8 -	3IVX	7.8	PANC_MYCTU
88	PsiBlast_CBE		71.49	45%	-46	- C8 -	4MUH	6.9	PANC_MYCTO
48	PsiBlast_CBE		71.46	45%	-47	- C8 -	4DDK	4.4	PANC_MYCTU
19	PsiBlast_PDB		71.42	45%	-49	- C8 -	3COZ	8.7	PANC_MYCTU
50	PsiBlast_CBE		71.38	45%	-47	- C8 -	4DDH	4.6	PANC_MYCTU
72	PsiBlast_CBE		71.21	45%	-48	- C8 -	3IME	3.1	PANC_MYCTU
54	PsiBlast_CBE		71.16	45%	-49	- C8 -	3IVG	2.6	PANC_MYCTU
58	PsiBlast_CBE		71.12	45%	-49	- C8 -	3IUE	7.8	PANC_MYCTU
122	HHSearch		70.61	40%	-45	- C8 -	3N8H	6.4	PANC_FRATT
90	PsiBlast_CBE		70.58	45%	-49	- C8 -	4MUG	7.1	PANC_MYCTO
56	PsiBlast_CBE		70.41	45%	-50	- C8 -	3IVC	7.1	PANC_MYCTU
61	PsiBlast_CBE		70.40	45%	-55	- C8 -	3IOE	7.8	PANC_MYCTU
64	PsiBlast_CBE		70.38	45%	-51	- C8 -	3IOD	8.0	PANC_MYCTU
47	PsiBlast_CBE		70.35	45%	-53	- C8 -	4DDK	4.0	PANC_MYCTU
75	PsiBlast_CBE		70.30	45%	-48	- C8 -	3COW	9.4	PANC_MYCTU
59	PsiBlast_CBE		70.14	45%	-49	- C8 -	3IUB	6.4	PANC_MYCTU
74	PsiBlast_CBE		70.09	45%	-49	- C8 -	3COY	8.9	PANC_MYCTU
92	PsiBlast_CBE		69.72	45%	-47	- C8 -	4MUF	8.2	PANC_MYCTO
86	PsiBlast_CBE		69.70	45%	-48	- C8 -	4MUI	7.6	PANC_MYCTO
76	PsiBlast_CBE		69.68	45%	-51	- C8 -	3COV	2.6	PANC_MYCTU
96	PsiBlast_CBE		69.67	45%	-43	- C8 -	4EFK	3.4	PANC_MYCTU
57	PsiBlast_CBE		69.63	45%	-49	- C8 -	3IUE	6.8	PANC_MYCTU
94	PsiBlast_CBE		69.36	45%	-45	- C8 -	4MUE	8.4	PANC_MYCTO
49	PsiBlast_CBE		69.01	45%	-56	- C8 -	4DDH	5.2	PANC_MYCTU
51	PsiBlast_CBE		68.97	45%	-49	- C8 -	3IVX	7.7	PANC_MYCTU
100	PsiBlast_CBE		68.95	45%	-54	- C8 -	3ISJ	5.1	PANC_MYCTU
77	PsiBlast_CBE		68.91	45%	-51	- C8 -	4MUN	7.4	PANC_MYCTO
99	PsiBlast_CBE		68.90	45%	-52	- C8 -	3LE8	8.5	PANC_MYCTU
53	PsiBlast_CBE		68.90	45%	-54	- C8 -	3IVG	7.5	PANC_MYCTU
65	PsiBlast_CBE		68.80	45%	-55	- C8 -	3IOC	8.5	PANC_MYCTU
39	PsiBlast_CBE		68.79	45%	-54	- C8 -	4G5Y	9.1	PANC_MYCTU
87	PsiBlast_CBE		68.78	45%	-54	- C8 -	4MUH	5.7	PANC_MYCTO
41	PsiBlast_CBE		68.75	45%	-51	- C8 -	4FZJ	4.4	PANC_MYCTU
45	PsiBlast_CBE		68.73	45%	-50	- C8 -	4DDM	3.0	PANC_MYCTU
73	PsiBlast_CBE		68.66	45%	-53	- C8 -	3IMC	4.3	PANC_MYCTU
67	PsiBlast_CBE		68.62	45%	-51	- C8 -	3IOB	6.3	PANC_MYCTU
66	PsiBlast_CBE		68.54	45%	-56	- C8 -	3IOC	8.1	PANC_MYCTU
97	PsiBlast_CBE		68.52	45%	-54	- C8 -	4EF6	4.6	PANC_MYCTU
85	PsiBlast_CBE		68.34	45%	-52	- C8 -	4MUI	7.3	PANC_MYCTO
63	PsiBlast_CBE		68.34	45%	-55	- C8 -	3IOD	9.8	PANC_MYCTU
43	PsiBlast_CBE		68.34	45%	-51	- C8 -	4DE5	4.1	PANC_MYCTU
89	PsiBlast_CBE		68.30	45%	-49	- C8 -	4MUG	6.5	PANC_MYCTO
71	PsiBlast_CBE		68.25	45%	-56	- C8 -	3IME	3.4	PANC_MYCTU
79	PsiBlast_CBE		68.23	45%	-53	- C8 -	4MUL	7.8	PANC_MYCTO
91	PsiBlast_CBE		68.07	45%	-53	- C8 -	4MUF	7.8	PANC_MYCTO
82	PsiBlast_CBE		67.79	45%	-53	- C8 -	4MUK	8.1	PANC_MYCTO
69	PsiBlast_CBE		67.74	45%	-53	- C8 -	3IMG	3.0	PANC_MYCTU
93	PsiBlast_CBE		67.69	45%	-55	- C8 -	4MUE	7.8	PANC_MYCTO
95	PsiBlast_CBE		67.63	45%	-53	- C8 -	4EFK	2.8	PANC_MYCTU
81	PsiBlast_CBE		67.41	45%	-53	- C8 -	4MUK	9.1	PANC_MYCTO
83	PsiBlast_CBE		67.12	45%	-52	- C8 -	4MUJ	8.0	PANC_MYCTO
55	PsiBlast_CBE		66.98	45%	-52	- C8 -	3IVC	7.5	PANC_MYCTU
35	PsiBlast_CBE		62.62	47%	-95	- C8 -	3Q10	5.6	PANC_YERPE
124	HHSearch		60.41	47%	-72	- C8 -	3GUZ	2.7	PANC_ECOLI
125	HHSearch		59.28	47%	-66	- C8 -	3GUZ	2.5	PANC_ECOLI