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Receptor
PDB id Resolution Class Description Source Keywords
1JS4 2 Å EC: 3.2.1.4 ENDO/EXOCELLULASE:CELLOBIOSE FROM THERMOMONOSPORA THERMOBIFIDA FUSCA GLYCOSYL HYDROLASE
Ref.: STRUCTURE AND MECHANISM OF ENDO/EXOCELLULASE E4 FROM THERMOMONOSPORA FUSCA. NAT.STRUCT.BIOL. V. 4 810 1997
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
BGC B:6015;
Valid;
none;
submit data
180.156 C6 H12 O6 C([C@...
BGC BGC B:6011;
Valid;
none;
submit data
326.298 n/a O(C1C...
BGC BGC BGC A:6001;
Valid;
none;
submit data
504.438 n/a O(C1C...
CA A:6166;
A:6168;
B:7166;
B:7168;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
submit data
40.078 Ca [Ca+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1JS4 2 Å EC: 3.2.1.4 ENDO/EXOCELLULASE:CELLOBIOSE FROM THERMOMONOSPORA THERMOBIFIDA FUSCA GLYCOSYL HYDROLASE
Ref.: STRUCTURE AND MECHANISM OF ENDO/EXOCELLULASE E4 FROM THERMOMONOSPORA FUSCA. NAT.STRUCT.BIOL. V. 4 810 1997
Members (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 40 families.
1 1JS4 - BGC BGC n/a n/a
2 4TF4 - BGC BGC BGC GLC n/a n/a
3 3TF4 - BGC BGC BGC n/a n/a
70% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 38 families.
1 1JS4 - BGC BGC n/a n/a
2 4TF4 - BGC BGC BGC GLC n/a n/a
3 3TF4 - BGC BGC BGC n/a n/a
50% Homology Family (8)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 29 families.
1 1IA7 - BGC BGC n/a n/a
2 1JS4 - BGC BGC n/a n/a
3 4TF4 - BGC BGC BGC GLC n/a n/a
4 3TF4 - BGC BGC BGC n/a n/a
5 4DOE - CBK C12 H22 O11 C([C@@H]1[....
6 1KFG - SGC BGC SGC GS1 n/a n/a
7 1GA2 - BGC BGC n/a n/a
8 1K72 - CBI C12 H22 O11 C([C@@H]1[....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: BGC; Similar ligands found: 142
No: Ligand ECFP6 Tc MDL keys Tc
1 WOO 1 1
2 GLC 1 1
3 BGC 1 1
4 ALL 1 1
5 BMA 1 1
6 GXL 1 1
7 GIV 1 1
8 GAL 1 1
9 MAN 1 1
10 GLA 1 1
11 Z6J 0.653846 0.866667
12 32O 0.653846 0.866667
13 RIB 0.653846 0.866667
14 FUB 0.653846 0.866667
15 AHR 0.653846 0.866667
16 MLB 0.511628 0.848485
17 GLC GLC 0.511628 0.848485
18 BGC GLC 0.511628 0.848485
19 BGC GLA 0.511628 0.848485
20 GLA BMA 0.511628 0.848485
21 MAN BMA 0.511628 0.848485
22 BMA GLA 0.511628 0.848485
23 GLA BGC 0.511628 0.848485
24 MAN MAN 0.511628 0.848485
25 GLA GLC 0.511628 0.848485
26 BMA MAN 0.511628 0.848485
27 GAL GLC 0.511628 0.848485
28 GAL GAL 0.511628 0.848485
29 LAK 0.511628 0.848485
30 GLC BGC 0.511628 0.848485
31 YDR 0.5 0.8
32 GLC GLC GLC GLC BGC 0.488889 0.848485
33 GLC GLC GLC 0.488889 0.848485
34 MAN MAN MAN 0.488889 0.848485
35 BMA MAN MAN 0.488889 0.848485
36 GLC GLC GLC GLC GLC BGC 0.488889 0.848485
37 EMZ 0.472222 0.794118
38 BG6 0.461538 0.675
39 BGP 0.461538 0.675
40 G6P 0.461538 0.675
41 M6P 0.461538 0.675
42 M6D 0.461538 0.675
43 A6P 0.461538 0.675
44 GAF 0.457143 0.875
45 SHG 0.457143 0.875
46 2FG 0.457143 0.875
47 G2F 0.457143 0.875
48 2H5 0.457143 0.875
49 GCS 0.457143 0.777778
50 1GN 0.457143 0.777778
51 X6X 0.457143 0.777778
52 PA1 0.457143 0.777778
53 95Z 0.457143 0.777778
54 G3F 0.457143 0.875
55 NGR 0.454545 0.848485
56 MAL 0.454545 0.848485
57 MAN GLC 0.454545 0.848485
58 GAL BGC 0.454545 0.848485
59 GLA GLA 0.454545 0.848485
60 BGC BMA 0.454545 0.848485
61 M3M 0.454545 0.848485
62 GLA GAL 0.454545 0.848485
63 MAB 0.454545 0.848485
64 GLC GAL 0.454545 0.848485
65 B2G 0.454545 0.848485
66 LBT 0.454545 0.848485
67 BMA GAL 0.454545 0.848485
68 LAT 0.454545 0.848485
69 BGC GAL 0.454545 0.848485
70 CBI 0.454545 0.848485
71 CBK 0.454545 0.848485
72 N9S 0.454545 0.848485
73 LB2 0.454545 0.848485
74 3MG 0.444444 0.875
75 TCB 0.444444 0.8
76 GLC SGC 0.444444 0.8
77 YIO 0.441176 0.870968
78 2GS 0.432432 0.875
79 2M4 0.431818 0.848485
80 AHR AHR 0.428571 0.764706
81 GLF 0.428571 0.84375
82 FUB AHR 0.428571 0.764706
83 MAN BMA BMA 0.416667 0.848485
84 BMA MAN BMA 0.416667 0.848485
85 CTR 0.416667 0.848485
86 BGC BGC BGC BGC BGC BGC BGC BGC BGC 0.416667 0.848485
87 GLA GAL BGC 0.416667 0.848485
88 CE5 0.416667 0.848485
89 MLR 0.416667 0.848485
90 CE6 0.416667 0.848485
91 MT7 0.416667 0.848485
92 BMA BMA BMA 0.416667 0.848485
93 GLC BGC BGC BGC BGC 0.416667 0.848485
94 MAN MAN BMA BMA BMA BMA 0.416667 0.848485
95 BGC BGC BGC BGC BGC 0.416667 0.848485
96 BGC GLC GLC GLC GLC GLC GLC 0.416667 0.848485
97 BGC GLC GLC 0.416667 0.848485
98 BMA BMA BMA BMA BMA 0.416667 0.848485
99 MAN BMA BMA BMA BMA 0.416667 0.848485
100 GLC GLC GLC GLC GLC GLC GLC GLC GLC 0.416667 0.848485
101 GLC BGC BGC BGC BGC BGC 0.416667 0.848485
102 MAN BMA BMA BMA BMA BMA 0.416667 0.848485
103 BGC BGC BGC BGC BGC BGC 0.416667 0.848485
104 BGC GLC GLC GLC 0.416667 0.848485
105 BGC BGC BGC GLC 0.416667 0.848485
106 CTT 0.416667 0.848485
107 GLA GAL GLC 0.416667 0.848485
108 MTT 0.416667 0.848485
109 GLC BGC BGC BGC 0.416667 0.848485
110 GLC GLC BGC 0.416667 0.848485
111 CEY 0.416667 0.848485
112 B4G 0.416667 0.848485
113 CE8 0.416667 0.848485
114 BMA BMA BMA BMA BMA BMA 0.416667 0.848485
115 GAL FUC 0.416667 0.848485
116 DXI 0.416667 0.848485
117 GLC BGC GLC 0.416667 0.848485
118 CT3 0.416667 0.848485
119 GAL GAL GAL 0.416667 0.848485
120 GLC GLC GLC GLC GLC 0.416667 0.848485
121 BGC BGC BGC BGC 0.416667 0.848485
122 BGC BGC BGC 0.416667 0.848485
123 BGC BGC GLC 0.416667 0.848485
124 CEX 0.416667 0.848485
125 GLC GAL GAL 0.416667 0.848485
126 BGC GLC GLC GLC GLC 0.416667 0.848485
127 GLC BGC BGC 0.416667 0.848485
128 GS1 GLC GS1 0.408163 0.8
129 SGC SGC BGC 0.408163 0.8
130 BGC BGC BGC GLC BGC BGC 0.408163 0.848485
131 GLC BGC BGC BGC BGC BGC BGC 0.408163 0.848485
132 1LL 0.405405 0.771429
133 TDG 0.405405 0.771429
134 TRE 0.405405 0.848485
135 NDG 0.404762 0.7
136 NGA 0.404762 0.7
137 NAG 0.404762 0.7
138 HSQ 0.404762 0.7
139 A2G 0.404762 0.7
140 BM3 0.404762 0.7
141 FUB AHR AHR 0.4 0.764706
142 AHR AHR AHR AHR AHR AHR 0.4 0.764706
Ligand no: 2; Ligand: BGC BGC; Similar ligands found: 204
No: Ligand ECFP6 Tc MDL keys Tc
1 BMA BMA 1 1
2 BGC BGC 1 1
3 AGL GLC 0.607143 0.772727
4 GAL NAG GAL BGC 0.605634 0.723404
5 GAL BGC BGC XYS 0.590909 0.916667
6 NAG BMA 0.57377 0.708333
7 G2F BGC BGC BGC BGC BGC 0.57377 0.846154
8 BGC BGC XYS BGC XYS GAL 0.573333 0.944444
9 BGC GAL 0.566038 0.914286
10 CBI 0.566038 0.914286
11 LAT 0.566038 0.914286
12 MAB 0.566038 0.914286
13 LBT 0.566038 0.914286
14 GLA GLA 0.566038 0.914286
15 BGC BMA 0.566038 0.914286
16 GLC GAL 0.566038 0.914286
17 BMA GAL 0.566038 0.914286
18 B2G 0.566038 0.914286
19 GAL BGC 0.566038 0.914286
20 GLA GAL 0.566038 0.914286
21 N9S 0.566038 0.914286
22 CBK 0.566038 0.914286
23 MAL 0.566038 0.914286
24 LAT GLA 0.54717 0.914286
25 TRE 0.543478 0.914286
26 BGC BGC BGC XYS GAL 0.541667 0.916667
27 BQZ 0.54 0.882353
28 NGR 0.537037 0.914286
29 M3M 0.537037 0.914286
30 LB2 0.537037 0.914286
31 MAN GLC 0.537037 0.914286
32 KHO 0.527273 0.864865
33 BGC GLC GLC GLC GLC 0.526316 0.914286
34 GLC GLC BGC 0.526316 0.914286
35 CEY 0.526316 0.914286
36 GLA GAL GLC 0.526316 0.914286
37 GAL GAL GAL 0.526316 0.914286
38 B4G 0.526316 0.914286
39 BGC BGC GLC 0.526316 0.914286
40 GLC BGC BGC 0.526316 0.914286
41 BGC BGC BGC 0.526316 0.914286
42 CTT 0.526316 0.914286
43 MTT 0.526316 0.914286
44 BMA BMA BMA 0.526316 0.914286
45 BMA BMA BMA BMA BMA BMA 0.526316 0.914286
46 BGC GLC GLC GLC 0.526316 0.914286
47 BGC BGC BGC BGC BGC BGC 0.526316 0.914286
48 MAN BMA BMA BMA BMA BMA 0.526316 0.914286
49 CT3 0.526316 0.914286
50 GLC GLC GLC GLC GLC GLC GLC GLC GLC 0.526316 0.914286
51 MAN BMA BMA 0.526316 0.914286
52 CTR 0.526316 0.914286
53 CE8 0.526316 0.914286
54 GLA GAL BGC 0.526316 0.914286
55 U63 0.526316 0.820513
56 GLC GAL GAL 0.526316 0.914286
57 CEX 0.526316 0.914286
58 GLC GLC GLC GLC GLC 0.526316 0.914286
59 GLC BGC BGC BGC BGC 0.526316 0.914286
60 MAN MAN BMA BMA BMA BMA 0.526316 0.914286
61 BGC BGC BGC BGC BGC 0.526316 0.914286
62 BMA MAN BMA 0.526316 0.914286
63 BGC GLC GLC 0.526316 0.914286
64 BGC GLC GLC GLC GLC GLC GLC 0.526316 0.914286
65 MT7 0.526316 0.914286
66 GLC BGC BGC BGC BGC BGC 0.526316 0.914286
67 MLR 0.526316 0.914286
68 CE5 0.526316 0.914286
69 BGC BGC BGC GLC 0.526316 0.914286
70 GLC BGC GLC 0.526316 0.914286
71 GLC BGC BGC BGC 0.526316 0.914286
72 BGC BGC BGC BGC 0.526316 0.914286
73 BGC BGC BGC BGC BGC BGC BGC BGC BGC 0.526316 0.914286
74 CE6 0.526316 0.914286
75 DXI 0.526316 0.914286
76 MAN BMA BMA BMA BMA 0.526316 0.914286
77 BMA BMA BMA BMA BMA 0.526316 0.914286
78 NOJ GLC 0.525424 0.755556
79 2M4 0.518519 0.914286
80 DR5 0.517857 0.864865
81 RZM 0.517857 0.711111
82 MMA MAN 0.517857 0.864865
83 5QP 0.517241 0.970588
84 BGC BGC BGC GLC BGC BGC 0.517241 0.914286
85 GLC BGC BGC BGC BGC BGC BGC 0.517241 0.914286
86 DOM 0.508772 0.916667
87 MAL EDO 0.508475 0.916667
88 IFM BMA 0.508475 0.733333
89 BMA IFM 0.508475 0.733333
90 IFM BGC 0.508475 0.733333
91 GLA GAL GAL 0.508197 0.914286
92 QPU 0.507246 0.790698
93 XYS BGC BGC XYS BGC XYS BGC BGC BGC 0.5 0.916667
94 GLC DMJ 0.5 0.755556
95 XYS BGC BGC BGC BGC XYS BGC BGC BGC 0.5 0.916667
96 BGC BGC BGC XYS BGC BGC 0.5 0.916667
97 BGC BGC BGC XYS BGC XYS GAL 0.493671 0.916667
98 GAL BGC BGC BGC XYS BGC XYS 0.493671 0.916667
99 GLA EGA 0.491525 0.864865
100 MDM 0.491228 0.864865
101 GAL MBG 0.491228 0.864865
102 M13 0.491228 0.864865
103 GLA MBG 0.490909 0.864865
104 GLC GLC XYP 0.484848 0.914286
105 9MR 0.483333 0.767442
106 BGC OXZ 0.483333 0.6875
107 GAL NAG GAL 0.479452 0.723404
108 BGC BGC BGC BGC BGC BGC BGC BGC 0.476923 0.914286
109 GAL NDG 0.47619 0.680851
110 NLC 0.47619 0.680851
111 NDG GAL 0.47619 0.680851
112 FMO 0.47541 0.8
113 NOY BGC 0.47541 0.653061
114 MAN MNM 0.47541 0.653061
115 GAL FUC 0.474576 0.861111
116 NAG NDG BMA 0.472973 0.653846
117 NAG NAG BMA 0.472973 0.653846
118 FUC NAG GAL 0.472222 0.68
119 GAL XYS XYS BGC BGC BGC XYS GAL BGC 0.46988 0.916667
120 BGC BGC XYS BGC GAL XYS BGC XYS GAL 0.46988 0.916667
121 GLC BGC BGC XYS BGC XYS XYS GAL 0.46988 0.916667
122 GAL BGC BGC BGC XYS XYS 0.46988 0.916667
123 GLC BGC BGC XYS BGC XYS XYS GAL GAL 0.46988 0.916667
124 CGC 0.467742 0.861111
125 ABL 0.467742 0.6875
126 MVP 0.467742 0.717391
127 G2I 0.462687 0.75
128 OXZ BGC BGC 0.462687 0.673469
129 G3I 0.462687 0.75
130 MAN G63 0.460317 0.708333
131 BMA BMA MAN 0.459016 0.914286
132 MAN MAN BMA 0.459016 0.914286
133 MAN 7D1 0.457627 0.916667
134 AHR XYS XYS 0.455882 0.891892
135 FUC BGC GAL 0.454545 0.888889
136 BMA MAN MAN MAN 0.453125 0.914286
137 GLA GAL BGC 5VQ 0.453125 0.820513
138 8VZ 0.453125 0.627451
139 GLC BDF 0.453125 0.944444
140 GLC GLC XYS 0.449275 0.888889
141 BGC BGC XYS BGC XYS BGC XYS 0.447368 0.916667
142 BGC BGC BGC XYS BGC XYS XYS 0.447368 0.916667
143 GLC BGC BGC XYS BGC XYS XYS 0.447368 0.916667
144 MAN BMA MAN 0.446154 0.914286
145 BGC BGC XYS BGC 0.445946 0.916667
146 BMA BMA GLA BMA BMA 0.442857 0.914286
147 LSE 0.442857 0.64
148 FRU GAL 0.442623 0.820513
149 BMA FRU 0.442623 0.820513
150 GLA GLA FUC 0.439394 0.888889
151 GAL GAL FUC 0.439394 0.888889
152 GLA GAL FUC 0.439394 0.888889
153 FUC GAL GLA 0.439394 0.888889
154 FUC GLA GLA 0.439394 0.888889
155 NAG NAG BMA MAN 0.439024 0.653846
156 AHR XYP XYP XYP 0.438356 0.891892
157 GDQ GLC 0.4375 0.6875
158 GLA MMA ABE 0.43662 0.846154
159 GLA MAN ABE 0.43662 0.891892
160 MAN BMA NAG 0.43662 0.680851
161 XYS GAL FUC 0.43662 0.916667
162 GLA GAL NAG 0.43662 0.680851
163 GLA GAL GLC NBU 0.432836 0.780488
164 GAL GAL SO4 0.432836 0.615385
165 GAL NGA 0.430769 0.680851
166 GAL A2G 0.430769 0.680851
167 A2G GAL 0.430769 0.680851
168 GAL MGC 0.430769 0.653061
169 GLC IFM 0.428571 0.711111
170 MAN IFM 0.428571 0.711111
171 MAN MAN MAN GLC 0.426471 0.914286
172 BGC BGC BGC FRU 0.426471 0.846154
173 LMT 0.42029 0.767442
174 UMQ 0.42029 0.767442
175 LMU 0.42029 0.767442
176 DMU 0.42029 0.767442
177 MAN DGO 0.419355 0.888889
178 T6P 0.416667 0.711111
179 10M 0.416667 0.717391
180 SOR GLC GLC 0.414286 0.942857
181 CM5 0.413333 0.868421
182 BGC GLA GAL FUC 0.413333 0.888889
183 ISX 0.412698 0.744186
184 AMG 0.411765 0.833333
185 MBG 0.411765 0.833333
186 MMA 0.411765 0.833333
187 GYP 0.411765 0.833333
188 NAG GAL GAL NAG GAL 0.410256 0.64
189 FUC NAG GLA GAL 0.409639 0.6875
190 MAN BMA MAN MAN MAN 0.408451 0.914286
191 M5S 0.408451 0.914286
192 GLC GLC GLC BGC 0.408451 0.914286
193 GAL NOK 0.408451 0.62963
194 EBG 0.40678 0.864865
195 GAL NAG MAN 0.405405 0.680851
196 AHR XYS XYP XYP XYP 0.405405 0.891892
197 XYT 0.402985 0.711111
198 SOR GLC GLC GLC 0.402778 0.942857
199 GLO GLC GLC GLC 0.402778 0.942857
200 6UZ 0.402778 0.825
201 GAL BGC NAG GAL 0.402597 0.680851
202 P3M 0.4 0.711111
203 3CU GLC 0.4 0.634615
204 GLC 7LQ 0.4 0.861111
Ligand no: 3; Ligand: BGC BGC BGC; Similar ligands found: 322
No: Ligand ECFP6 Tc MDL keys Tc
1 GLC BGC GLC 1 1
2 CE8 1 1
3 BGC GLC GLC GLC 1 1
4 CT3 1 1
5 GLA GAL GLC 1 1
6 MAN MAN BMA BMA BMA BMA 1 1
7 BGC GLC GLC 1 1
8 BGC BGC BGC BGC 1 1
9 GLC BGC BGC BGC BGC BGC 1 1
10 GLC BGC BGC 1 1
11 GLC GLC GLC GLC GLC GLC GLC GLC GLC 1 1
12 BGC GLC GLC GLC GLC 1 1
13 B4G 1 1
14 CEY 1 1
15 GLC GLC BGC 1 1
16 MAN BMA BMA BMA BMA 1 1
17 MLR 1 1
18 GAL GAL GAL 1 1
19 BGC BGC BGC BGC BGC BGC 1 1
20 MAN BMA BMA BMA BMA BMA 1 1
21 GLC BGC BGC BGC 1 1
22 CTT 1 1
23 DXI 1 1
24 CEX 1 1
25 CE5 1 1
26 GLC GLC GLC GLC GLC 1 1
27 BMA MAN BMA 1 1
28 CE6 1 1
29 BGC BGC BGC BGC BGC BGC BGC BGC BGC 1 1
30 GLA GAL BGC 1 1
31 BMA BMA BMA 1 1
32 MTT 1 1
33 MAN BMA BMA 1 1
34 GLC GAL GAL 1 1
35 BGC BGC BGC 1 1
36 BGC BGC BGC BGC BGC 1 1
37 BGC GLC GLC GLC GLC GLC GLC 1 1
38 BGC BGC GLC 1 1
39 BMA BMA BMA BMA BMA BMA 1 1
40 BMA BMA BMA BMA BMA 1 1
41 CTR 1 1
42 GLC BGC BGC BGC BGC 1 1
43 BGC BGC BGC GLC 1 1
44 MT7 1 1
45 LBT 0.909091 1
46 BMA GAL 0.909091 1
47 GLA GLA 0.909091 1
48 CBI 0.909091 1
49 LAT 0.909091 1
50 BGC GAL 0.909091 1
51 BGC BMA 0.909091 1
52 GLC GAL 0.909091 1
53 MAL 0.909091 1
54 GLA GAL 0.909091 1
55 B2G 0.909091 1
56 GAL BGC 0.909091 1
57 CBK 0.909091 1
58 MAB 0.909091 1
59 N9S 0.909091 1
60 BGC BGC BGC BGC BGC BGC BGC BGC 0.830189 1
61 LAT GLA 0.765957 1
62 BMA BMA GLA BMA BMA 0.758621 1
63 GLA GAL GAL 0.754717 1
64 GLC GLC GLC BGC 0.741379 1
65 BMA BMA BMA BMA 0.672414 0.941176
66 MMA MAN 0.653846 0.942857
67 DR5 0.653846 0.942857
68 NGA GAL BGC 0.650794 0.733333
69 GLA EGA 0.648148 0.942857
70 XYS BGC BGC XYS BGC XYS BGC BGC BGC 0.647059 0.942857
71 XYS BGC BGC BGC BGC XYS BGC BGC BGC 0.647059 0.942857
72 BGC BGC BGC XYS BGC BGC 0.647059 0.942857
73 XYT 0.637931 0.767442
74 ABD 0.637681 0.75
75 GAL NGA GLA BGC GAL 0.628571 0.733333
76 GLC GLC XYP 0.622951 1
77 GLA GAL BGC 5VQ 0.62069 0.891892
78 G2F BGC BGC BGC BGC BGC 0.616667 0.868421
79 BGC BGC XYS BGC 0.61194 0.942857
80 MAL EDO 0.607143 0.942857
81 U63 0.6 0.891892
82 BGC BGC BGC XYS GAL 0.6 0.942857
83 NGA GLA GAL BGC 0.591549 0.733333
84 GLA GAL GLC NBU 0.590164 0.846154
85 M3M 0.584906 1
86 LB2 0.584906 1
87 NGR 0.584906 1
88 MAN GLC 0.584906 1
89 BGC BGC BGC FRU 0.580645 0.868421
90 LAT NAG GAL 0.577465 0.733333
91 GLC GAL NAG GAL 0.577465 0.733333
92 BGC GLA GAL FUC 0.573529 0.970588
93 G2I 0.571429 0.767442
94 LAT FUC 0.571429 0.970588
95 GAL FUC 0.571429 0.941176
96 BGC GAL NAG GAL 0.571429 0.733333
97 OXZ BGC BGC 0.571429 0.6875
98 GAL NAG GAL GLC 0.571429 0.733333
99 BGC GAL FUC 0.571429 0.970588
100 FUC GAL GLC 0.571429 0.970588
101 GLC GLC G6D ACI GLC GLC GLC 0.571429 0.733333
102 G3I 0.571429 0.767442
103 GLC GAL FUC 0.571429 0.970588
104 8B7 0.571429 0.970588
105 2M4 0.566038 1
106 BQZ 0.56 0.909091
107 GLC GLC XYS 0.553846 0.970588
108 SOR GLC GLC GLC 0.545455 0.970588
109 GLO GLC GLC GLC 0.545455 0.970588
110 BGC BGC BGC XYS BGC XYS GAL 0.545455 0.942857
111 LAG 0.545455 0.6
112 GAL BGC BGC BGC XYS BGC XYS 0.545455 0.942857
113 GLC GLC DAF BGC 0.54321 0.702128
114 GLC GLC AGL HMC GLC 0.54321 0.702128
115 ARE 0.54321 0.733333
116 ACR GLC GLC GLC 0.54321 0.702128
117 GLC GLC ACI G6D GLC GLC 0.54321 0.702128
118 AAO 0.54321 0.733333
119 GLC BGC BGC XYS BGC XYS XYS 0.541667 0.942857
120 BGC BGC XYS BGC XYS BGC XYS 0.541667 0.942857
121 BGC BGC BGC XYS BGC XYS XYS 0.541667 0.942857
122 GAL NDG 0.540984 0.733333
123 NLC 0.540984 0.733333
124 5GO 0.540984 0.66
125 NDG GAL 0.540984 0.733333
126 GAL BGC BGC XYS 0.536232 0.942857
127 BGC BGC BGC GLC BGC BGC 0.534483 1
128 GLC BGC BGC BGC BGC BGC BGC 0.534483 1
129 DEL 0.534483 0.970588
130 MVP 0.533333 0.733333
131 SGA BGC 0.532258 0.66
132 TRE 0.531915 1
133 BGC BGC 0.526316 0.914286
134 BMA BMA 0.526316 0.914286
135 LMT 0.523077 0.785714
136 LMU 0.523077 0.785714
137 UMQ 0.523077 0.785714
138 DMU 0.523077 0.785714
139 NAG GAL BGC 0.521127 0.733333
140 GLC ACI GLD GLC 0.519481 0.733333
141 GLC G6D ACI GLC 0.519481 0.733333
142 GLC G6D ADH GLC 0.519481 0.733333
143 GLC ACI G6D BGC 0.519481 0.733333
144 GAL XYS XYS BGC BGC BGC XYS GAL BGC 0.518519 0.942857
145 GAL BGC BGC BGC XYS XYS 0.518519 0.942857
146 GLC BGC BGC XYS BGC XYS XYS GAL 0.518519 0.942857
147 GLC BGC BGC XYS BGC XYS XYS GAL GAL 0.518519 0.942857
148 BGC BGC XYS BGC GAL XYS BGC XYS GAL 0.518519 0.942857
149 BMA MAN MAN MAN 0.516129 1
150 FUC BGC GAL 0.515625 0.970588
151 SOR GLC GLC 0.515152 0.970588
152 RCB 0.514286 0.622642
153 GAL BGC NAG GAL 0.513889 0.733333
154 GLA MBG 0.509091 0.942857
155 ACI GLD GLC GAL 0.506667 0.733333
156 DAF GLC GLC 0.506667 0.733333
157 DAF BGC GLC 0.506667 0.733333
158 6UZ 0.5 0.846154
159 TXT 0.5 0.767442
160 GAC 0.5 0.767442
161 BMA BMA MAN 0.5 1
162 MAN MAN BMA 0.5 1
163 GLC ACI GLD GAL 0.493827 0.702128
164 GLC ACI G6D GLC 0.493827 0.702128
165 QV4 0.493827 0.733333
166 GLC GLC GLC PO4 SGC GLC 0.487805 0.66
167 NPJ 0.485714 0.622642
168 MAN BMA MAN 0.484375 1
169 ACR 0.481013 0.733333
170 QPS 0.481013 0.733333
171 4MU BGC BGC BGC BGC 0.480519 0.767442
172 GAL NAG MAN 0.478873 0.733333
173 DOM 0.474576 0.942857
174 GLO GLC GLC 0.472222 0.942857
175 GLA GAL NAG 0.471429 0.733333
176 10M 0.471429 0.733333
177 MAN BMA NAG 0.471429 0.733333
178 GAL GAL SO4 0.469697 0.66
179 8VZ 0.46875 0.673469
180 FMO 0.467742 0.868421
181 4MU BGC BGC 0.467532 0.767442
182 BGC BGC SGC MGL 0.465753 0.868421
183 MGL SGC GLC GLC 0.465753 0.868421
184 CM5 0.465753 0.891892
185 MGL SGC BGC BGC 0.465753 0.868421
186 ACR GLC 0.4625 0.702128
187 ACR GLC GLC GLC GLC 0.4625 0.702128
188 NAG GAL GAL NAG GAL 0.460526 0.6875
189 CGC 0.460317 0.941176
190 MA4 0.459459 0.891892
191 5QP 0.459016 0.885714
192 ACI G6D GLC ACI G6D BGC 0.457831 0.702128
193 ACI GLD GLC GLC GLC ACI GLD GLC GAL 0.457831 0.702128
194 BGC GLC AC1 GLC GLC GLC AC1 0.457831 0.702128
195 AC1 GLC AC1 BGC 0.457831 0.702128
196 DAF GLC DAF GLC GLC 0.457831 0.702128
197 ACI GLD GLC ACI G6D BGC 0.457831 0.702128
198 M13 0.457627 0.942857
199 MDM 0.457627 0.942857
200 GAL MBG 0.457627 0.942857
201 RZM 0.457627 0.688889
202 LSE 0.457143 0.6875
203 GLA GAL NAG FUC GAL GLC 0.454545 0.717391
204 G6D GLC ACI GLD GLC ACI GLD GLC BGC 0.453488 0.653061
205 GTM BGC BGC 0.450704 0.868421
206 MAN MAN MAN MAN 0.449275 1
207 MAN MAN BMA MAN 0.449275 1
208 ACG 0.448276 0.695652
209 NAG BMA 0.447761 0.653061
210 FUC GAL NAG GAL BGC 0.447059 0.717391
211 GAL GLC NAG GAL FUC 0.447059 0.717391
212 GLC NAG GAL GAL FUC 0.447059 0.717391
213 GAL A2G 0.446154 0.733333
214 A2G GAL 0.446154 0.733333
215 GAL NGA 0.446154 0.733333
216 BMA MAN MAN MAN MAN 0.444444 1
217 MAN BMA MAN MAN MAN 0.442857 1
218 M5S 0.442857 1
219 NAG GAL GAL NAG 0.441558 0.6875
220 GAL NAG GAL NAG GAL NAG 0.441558 0.673469
221 MAN MAN MAN GLC 0.441176 1
222 GLA GLC 0.440678 1
223 BGC GLA 0.440678 1
224 MAN BMA 0.440678 1
225 BGC GLC 0.440678 1
226 GLA BGC 0.440678 1
227 MAN MAN 0.440678 1
228 GLC BGC 0.440678 1
229 BMA MAN 0.440678 1
230 LAK 0.440678 1
231 GAL GAL 0.440678 1
232 BMA GLA 0.440678 1
233 GLA BMA 0.440678 1
234 GAL GLC 0.440678 1
235 MLB 0.440678 1
236 GLC GLC 0.440678 1
237 DAF GLC 0.44 0.733333
238 DAF BGC 0.44 0.733333
239 BGC SGC BGC SGC BGC SGC BGC SGC 0.438356 0.916667
240 TM6 0.438356 0.916667
241 ABL 0.4375 0.702128
242 FRU GAL 0.435484 0.842105
243 BMA FRU 0.435484 0.842105
244 FUC GAL GLA 0.432836 0.970588
245 GLA GAL FUC 0.432836 0.970588
246 GLA GLA FUC 0.432836 0.970588
247 GAL GAL FUC 0.432836 0.970588
248 FUC GLA GLA 0.432836 0.970588
249 BMA IFM 0.428571 0.711111
250 A2G GAL BGC FUC 0.428571 0.717391
251 BGC OXZ 0.428571 0.666667
252 IFM BGC 0.428571 0.711111
253 VAM 0.428571 0.868421
254 IFM BMA 0.428571 0.711111
255 GLF B8D 0.428571 0.775
256 9MR 0.428571 0.744186
257 ISX 0.428571 0.761905
258 BGC GAL NAG GAL FUC FUC 0.426966 0.702128
259 7SA 0.426966 0.702128
260 GLC GAL NAG GAL FUC FUC 0.426966 0.702128
261 MAN MAN MAN BMA MAN 0.426667 1
262 GLC GLC GLC GLC GLC BGC 0.42623 1
263 BMA MAN MAN 0.42623 1
264 GLC GLC GLC 0.42623 1
265 MAN MAN MAN 0.42623 1
266 GLC GLC GLC GLC BGC 0.42623 1
267 NOJ GLC 0.421875 0.695652
268 GLC DMJ 0.421875 0.695652
269 NOY BGC 0.421875 0.702128
270 MAN MNM 0.421875 0.702128
271 PA1 GCS 0.419355 0.767442
272 GCS GCS 0.419355 0.767442
273 HMC AGL GLC 0.417722 0.717391
274 3SA 0.417722 0.733333
275 GAL 0.416667 0.848485
276 GXL 0.416667 0.848485
277 ALL 0.416667 0.848485
278 6SA 0.416667 0.733333
279 GLA 0.416667 0.848485
280 GLC 0.416667 0.848485
281 MAN 0.416667 0.848485
282 XZZ BGC BGC 0.416667 0.702128
283 WOO 0.416667 0.848485
284 BMA 0.416667 0.848485
285 BGC 0.416667 0.848485
286 GIV 0.416667 0.848485
287 HSD G6D GLC HSD G6D GLC BGC 0.41573 0.673469
288 ACI G6D GLC ACI G6D GLC GLC 0.41573 0.673469
289 HSD G6D GLC HSD G6D GLC GLC 0.41573 0.673469
290 ACI GLD GLC ACI GLD GLC ACI GLD GLC GLC 0.41573 0.673469
291 GAL NAG GAL 0.415584 0.702128
292 GCS GCS GCS GCS GCS 0.415385 0.767442
293 GCS GCS GCS GCS GCS GCS 0.415385 0.767442
294 GCS GCS GCS 0.415385 0.767442
295 P3M 0.414286 0.767442
296 MAN DGO 0.412698 0.914286
297 AGL GLC HMC AGL GLC BGC 0.411111 0.653061
298 NAG NDG BMA 0.410256 0.634615
299 NAG NAG BMA 0.410256 0.634615
300 T6P 0.409836 0.767442
301 GDQ GLC 0.409091 0.666667
302 MAN G63 0.409091 0.653061
303 FUC BGC GAL NAG GAL 0.409091 0.717391
304 AMG 0.403846 0.857143
305 GYP 0.403846 0.857143
306 MMA 0.403846 0.857143
307 MBG 0.403846 0.857143
308 MAN 7D1 0.403226 0.888889
309 GAL MGC 0.402985 0.702128
310 BGC BGC XYS BGC XYS GAL 0.4 0.916667
311 Z6J 0.4 0.742857
312 RIB 0.4 0.742857
313 FUC NDG GAL 0.4 0.717391
314 A2G MBG 0.4 0.702128
315 A2G GAL NAG FUC GAL GLC 0.4 0.673469
316 AHR 0.4 0.742857
317 GLC GAL NAG GAL FUC A2G 0.4 0.673469
318 MAN MAN MAN MAN MAN MAN MAN 0.4 1
319 GAL NDG FUC 0.4 0.717391
320 FUB 0.4 0.742857
321 32O 0.4 0.742857
322 MBG A2G 0.4 0.702128
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1JS4; Ligand: BGC BGC; Similar sites found with APoc: 18
This union binding pocket(no: 1) in the query (biounit: 1js4.bio2) has 25 residues
No: Leader PDB Ligand Sequence Similarity
1 1ZEI CRS None
2 1FUR MLT 1.71306
3 5XQL C2E 2.4055
4 1VBJ CIT 2.4911
5 4TQK NAG 2.70936
6 5MB4 NAG 2.99252
7 5MB4 NDG 2.99252
8 4ZZE GLC GLC GLC 3.0303
9 4UP4 GAL NAG 3.49127
10 4UP4 NAG 3.49127
11 4UP4 NDG 3.49127
12 4NZF ARB 4.01786
13 5JNW 6LJ 5.03145
14 5DGR GCS 5.80205
15 4LWM MHO 6.91244
16 5D3X 4IP 7.18563
17 2BOS GLA GAL 8.82353
18 1RQ5 CTT 28.7603
Pocket No.: 2; Query (leader) PDB : 1JS4; Ligand: BGC; Similar sites found with APoc: 17
This union binding pocket(no: 2) in the query (biounit: 1js4.bio2) has 26 residues
No: Leader PDB Ligand Sequence Similarity
1 1ZEI CRS None
2 1FUR MLT 1.71306
3 5H6S HDH 1.8711
4 5XQL C2E 2.4055
5 1VBJ CIT 2.4911
6 4TQK NAG 2.70936
7 4EZD SEY 2.80992
8 5MB4 NAG 2.99252
9 5MB4 NDG 2.99252
10 4ZZE GLC GLC GLC 3.0303
11 4UP4 GAL NAG 3.49127
12 4UP4 NAG 3.49127
13 4UP4 NDG 3.49127
14 4NZF ARB 4.01786
15 5DGR GCS 5.80205
16 5D3X 4IP 7.18563
17 1RQ5 CTT 28.7603
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