Receptor
PDB id Resolution Class Description Source Keywords
5FU2 1.4 Å NON-ENZYME: OTHER THE COMPLEXITY OF THE RUMINOCOCCUS FLAVEFACIENS CELLULOSOME REFLECTS AN EXPANSION IN GLYCAN RECOGNITION RUMINOCOCCUS FLAVEFACIENS CELLULOSOME CARBOHYDRATE BINDING MODULE RUMINOCCOCUS FLAVEENDOGLUCANASE CEL5A SUGAR BINDING PROTEIN
Ref.: COMPLEXITY OF THE RUMINOCOCCUS FLAVEFACIENS CELLULO REFLECTS AN EXPANSION IN GLYCAN RECOGNITION. PROC.NATL.ACAD.SCI.USA V. 113 7136 2016
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
BMA BMA BMA BMA BMA A:1509;
Valid;
none;
Ka = 17000 M^-1
828.72 n/a O(C1O...
CA B:1515;
Part of Protein;
none;
submit data
40.078 Ca [Ca+2...
BMA BMA BMA BMA BMA BMA MAN B:1509;
Valid;
Atoms found MORE than expected: % Diff = 1.154;
Ka = 17000 M^-1
1171.02 n/a O(C1O...
NA B:1518;
B:1517;
B:1516;
Part of Protein;
Part of Protein;
Invalid;
none;
none;
none;
submit data
22.99 Na [Na+]
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5FU3 1.61 Å NON-ENZYME: OTHER THE COMPLEXITY OF THE RUMINOCOCCUS FLAVEFACIENS CELLULOSOME REFLECTS AN EXPANSION IN GLYCAN RECOGNITION RUMINOCOCCUS FLAVEFACIENS CELLULOSOME CARBOHYDRATE BINDING MODULE RUMINOCCOCUS FLAVEENDOGLUCANASE CEL5A SUGAR BINDING PROTEIN
Ref.: COMPLEXITY OF THE RUMINOCOCCUS FLAVEFACIENS CELLULO REFLECTS AN EXPANSION IN GLYCAN RECOGNITION. PROC.NATL.ACAD.SCI.USA V. 113 7136 2016
Members (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1256 families.
1 5FU3 Ka = 41000 M^-1 BGC BGC BGC n/a n/a
2 5FU2 Ka = 17000 M^-1 BMA BMA BMA BMA BMA n/a n/a
3 5FU4 - BMA BMA BMA BMA BMA 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 1068 families.
1 5FU3 Ka = 41000 M^-1 BGC BGC BGC n/a n/a
2 5FU2 Ka = 17000 M^-1 BMA BMA BMA BMA BMA n/a n/a
3 5FU4 - BMA BMA BMA BMA BMA n/a n/a
50% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 922 families.
1 5FU3 Ka = 41000 M^-1 BGC BGC BGC n/a n/a
2 5FU2 Ka = 17000 M^-1 BMA BMA BMA BMA BMA n/a n/a
3 5FU4 - BMA BMA BMA BMA BMA n/a n/a
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: BMA BMA BMA BMA BMA; Similar ligands found: 333
No: Ligand ECFP6 Tc MDL keys Tc
1 GLA GAL GLC 1 1
2 GLC GAL GAL 1 1
3 MAN MAN BMA BMA BMA BMA 1 1
4 CEX 1 1
5 MAN BMA BMA 1 1
6 CT3 1 1
7 MTT 1 1
8 BGC GLC GLC GLC 1 1
9 BGC BGC BGC GLC 1 1
10 GLC BGC GLC 1 1
11 CE8 1 1
12 MLR 1 1
13 BGC BGC BGC BGC BGC BGC BGC BGC BGC 1 1
14 GAL GAL GAL 1 1
15 BGC GLC GLC GLC GLC GLC GLC 1 1
16 MT7 1 1
17 GLC BGC BGC 1 1
18 CEY 1 1
19 BMA BMA BMA 1 1
20 GLC BGC BGC BGC BGC BGC 1 1
21 MAN BMA BMA BMA BMA 1 1
22 GLC GLC BGC GLC GLC GLC GLC 1 1
23 B4G 1 1
24 BGC GLC GLC 1 1
25 GLC GLC BGC 1 1
26 GLC GLC GLC GLC GLC GLC GLC 1 1
27 DXI 1 1
28 GLC BGC BGC BGC BGC 1 1
29 GLC GLC GLC GLC GLC GLC GLC GLC 1 1
30 GLC GLC GLC GLC GLC 1 1
31 CTT 1 1
32 BMA BMA BMA BMA BMA 1 1
33 BMA BMA BMA BMA BMA BMA 1 1
34 BGC GLC GLC GLC GLC 1 1
35 BMA MAN BMA 1 1
36 CE5 1 1
37 CTR 1 1
38 CE6 1 1
39 BGC BGC BGC BGC BGC BGC 1 1
40 GLC GLC GLC GLC GLC GLC GLC GLC GLC 1 1
41 BMA BMA BMA BMA BMA BMA MAN 0.916667 0.970588
42 MAN BMA BMA BMA BMA BMA 0.916667 0.970588
43 BGC BMA 0.909091 1
44 LBT 0.909091 1
45 LAT 0.909091 1
46 GLC BGC 0.909091 1
47 GAL GLC 0.909091 1
48 BGC GAL 0.909091 1
49 MAB 0.909091 1
50 GLA GLA 0.909091 1
51 BMA GAL 0.909091 1
52 B2G 0.909091 1
53 N9S 0.909091 1
54 BGC GLC 0.909091 1
55 CBK 0.909091 1
56 GLA GAL 0.909091 1
57 BMA BMA 0.909091 1
58 GLC GAL 0.909091 1
59 CBI 0.909091 1
60 GAL BGC 0.909091 1
61 MAL MAL 0.909091 0.970588
62 MAL 0.909091 1
63 BGC BGC BGC BGC 0.830189 1
64 BGC BGC BGC BGC BGC BGC BGC BGC 0.830189 1
65 LAT GLA 0.765957 1
66 BMA BMA GLA BMA BMA 0.758621 1
67 GLA GAL GAL 0.754717 1
68 GLA GAL BGC 0.754717 1
69 GLC GLC GLC BGC 0.741379 1
70 BGC BGC GLC 0.735849 1
71 GLC GLC GLC GLC GLC GLC 0.677966 1
72 DR5 0.653846 0.942857
73 MMA MAN 0.653846 0.942857
74 NGA GAL BGC 0.650794 0.733333
75 GLA EGA 0.648148 0.942857
76 XYS BGC BGC BGC BGC XYS BGC BGC BGC 0.647059 0.942857
77 BGC BGC BGC XYS BGC BGC 0.647059 0.942857
78 XYS BGC BGC XYS BGC XYS BGC BGC BGC 0.647059 0.942857
79 ABD 0.637681 0.75
80 GAL NGA GLA BGC GAL 0.628571 0.733333
81 GLC GLC XYP 0.622951 1
82 GLA GAL BGC 5VQ 0.62069 0.891892
83 GLC GLC BGC XYS BGC XYS 0.617647 0.942857
84 G2F BGC BGC BGC BGC BGC 0.616667 0.868421
85 BGC BGC XYS BGC 0.61194 0.942857
86 MAL EDO 0.607143 0.942857
87 U63 0.6 0.891892
88 BGC BGC BGC XYS GAL 0.6 0.942857
89 NGA GLA GAL BGC 0.591549 0.733333
90 GLA GAL GLC NBU 0.590164 0.846154
91 M3M 0.584906 1
92 MAN GLC 0.584906 1
93 LB2 0.584906 1
94 GLC GAL NAG GAL 0.577465 0.733333
95 BGC GLA GAL FUC 0.573529 0.970588
96 OXZ BGC BGC 0.571429 0.6875
97 GAL FUC 0.571429 0.941176
98 GAL NAG GAL BGC 0.571429 0.733333
99 G2I 0.571429 0.767442
100 BGC GAL FUC 0.571429 0.970588
101 BMA BMA MAN 0.571429 0.970588
102 GLC GLC G6D ACI GLC GLC GLC 0.571429 0.785714
103 GLC GAL FUC 0.571429 0.970588
104 G3I 0.571429 0.767442
105 FUC LAT 0.571429 0.970588
106 BGC GAL NAG GAL 0.571429 0.733333
107 LAT FUC 0.571429 0.970588
108 FUC GAL GLC 0.571429 0.970588
109 LAT NAG GAL 0.571429 0.733333
110 2M4 0.566038 1
111 MAN MAN 0.566038 1
112 BGC BGC 0.566038 1
113 SGA BGC 0.559322 0.702128
114 GLC GLC XYS 0.553846 0.970588
115 BGC BGC BGC XYS BGC XYS GAL 0.545455 0.942857
116 GAL BGC BGC BGC XYS BGC XYS 0.545455 0.942857
117 SOR GLC GLC GLC 0.545455 0.970588
118 LAG 0.545455 0.6
119 ACR GLC GLC GLC 0.54321 0.733333
120 ARE 0.54321 0.733333
121 GLC GLC DAF BGC 0.54321 0.733333
122 GLC GLC ACI G6D GLC GLC 0.54321 0.733333
123 GLC GLC AGL HMC GLC 0.54321 0.733333
124 AAO 0.54321 0.733333
125 BGC BGC G2F SHG 0.542857 0.846154
126 BGC BGC BGC XYS BGC XYS XYS 0.541667 0.942857
127 GLC BGC BGC XYS BGC XYS XYS 0.541667 0.942857
128 BGC BGC XYS BGC XYS BGC XYS 0.541667 0.942857
129 NLC 0.540984 0.733333
130 5GO 0.540984 0.66
131 GAL NDG 0.540984 0.733333
132 NDG GAL 0.540984 0.733333
133 GLC GLC GLC G6D ADH GLC 0.536585 0.6875
134 GLC GLC FRU 0.536232 0.868421
135 GAL BGC BGC XYS 0.536232 0.942857
136 GLC BGC BGC BGC BGC BGC BGC 0.534483 1
137 GLC BGC BGC BGC 0.534483 1
138 DEL 0.534483 0.970588
139 BGC BGC BGC 0.534483 1
140 BGC BGC BGC BGC BGC 0.534483 1
141 BGC BGC BGC GLC BGC BGC 0.534483 1
142 BGC BGC BGC ASO BGC BGC ASO 0.534483 1
143 MVP 0.533333 0.733333
144 TRE 0.531915 1
145 GLC BGC BGC BGC XYS BGC XYS XYS 0.526316 0.916667
146 BMA MAN 0.526316 0.914286
147 BMA MAN MAN 0.52459 1
148 DMU 0.523077 0.785714
149 LMT 0.523077 0.785714
150 LMU 0.523077 0.785714
151 UMQ 0.523077 0.785714
152 NAG GAL BGC 0.521127 0.733333
153 GLC ACI GLD GLC 0.519481 0.785714
154 GLC G6D ACI GLC 0.519481 0.785714
155 GLC G6D ADH GLC 0.519481 0.785714
156 GLC ACI G6D BGC 0.519481 0.785714
157 GLC BGC BGC XYS BGC XYS XYS GAL 0.518519 0.942857
158 GAL BGC BGC BGC XYS XYS 0.518519 0.942857
159 GLC BGC BGC XYS BGC XYS XYS GAL GAL 0.518519 0.942857
160 GAL XYS XYS BGC BGC BGC XYS GAL BGC 0.518519 0.942857
161 BGC BGC XYS BGC GAL XYS BGC XYS GAL 0.518519 0.942857
162 FUC BGC GAL 0.515625 0.970588
163 SOR GLC GLC 0.515152 0.970588
164 RCB 0.514286 0.622642
165 GAL BGC NAG GAL 0.513889 0.733333
166 GAL GAL GLC EMB MEC 0.512195 0.622642
167 GLA MBG 0.509091 0.942857
168 6UZ 0.5 0.846154
169 GAC 0.5 0.767442
170 ACI GLD GLC GAL 0.5 0.785714
171 GLC AGL GLC HMC 0.5 0.717391
172 GAL GAL SO4 0.5 0.702128
173 GLO GLC GLC GLC 0.5 0.942857
174 DAF GLC GLC 0.5 0.785714
175 TXT 0.5 0.767442
176 MAN MAN BMA 0.5 1
177 DAF BGC GLC 0.5 0.785714
178 GLC GLC GLC PO4 SGC GLC 0.5 0.673469
179 GLC ACI GLD GAL 0.493827 0.733333
180 QV4 0.493827 0.733333
181 GLC ACI G6D GLC 0.493827 0.733333
182 NPJ 0.485714 0.622642
183 ACR 0.481013 0.733333
184 QPS 0.481013 0.733333
185 4MU BGC BGC BGC BGC 0.480519 0.767442
186 GAL NAG MAN 0.478873 0.733333
187 MAN NAG GAL 0.478873 0.733333
188 DOM 0.474576 0.942857
189 GLO GLC GLC 0.472222 0.942857
190 MAN BMA NAG 0.471429 0.733333
191 10M 0.471429 0.733333
192 GLA GAL NAG 0.471429 0.733333
193 NAG GAL GAL 0.471429 0.733333
194 8VZ 0.46875 0.673469
195 ACR GLC 0.468354 0.733333
196 ACR GLC GLC GLC GLC 0.468354 0.733333
197 FMO 0.467742 0.868421
198 4MU BGC BGC 0.467532 0.767442
199 MGL SGC GLC GLC 0.465753 0.868421
200 CM5 0.465753 0.891892
201 BGC BGC SGC MGL 0.465753 0.868421
202 NAG GAL GAL NAG GAL 0.460526 0.6875
203 CGC 0.460317 0.941176
204 MA4 0.459459 0.891892
205 5QP 0.459016 0.885714
206 BGC GLC AC1 GLC GLC GLC AC1 0.457831 0.75
207 ACI G6D GLC ACI G6D BGC 0.457831 0.75
208 ACI GLD GLC ACI G6D BGC 0.457831 0.75
209 AC1 GLC AC1 BGC 0.457831 0.75
210 DAF GLC DAF GLC GLC 0.457831 0.75
211 ACI GLD GLC GLC GLC ACI GLD GLC GAL 0.457831 0.75
212 GAL MBG 0.457627 0.942857
213 RZM 0.457627 0.688889
214 M13 0.457627 0.942857
215 MDM 0.457627 0.942857
216 LSE 0.457143 0.6875
217 GLA GAL NAG FUC GAL GLC 0.454545 0.717391
218 G6D GLC ACI GLD GLC ACI GLD GLC BGC 0.453488 0.680851
219 MAN MNM 0.451613 0.75
220 GTM BGC BGC 0.450704 0.868421
221 MAN MAN MAN MAN 0.449275 1
222 MAN MAN BMA MAN 0.449275 1
223 ACG 0.448276 0.695652
224 GLC GLC GLC GLC 0.447761 1
225 NAG BMA 0.447761 0.653061
226 FUC GAL NAG GAL BGC 0.447059 0.717391
227 GAL A2G 0.446154 0.733333
228 GAL NGA 0.446154 0.733333
229 A2G GAL 0.446154 0.733333
230 NOJ GLC 0.444444 0.727273
231 MAN BMA MAN MAN MAN 0.442857 1
232 M5S 0.442857 1
233 GAL NAG GAL NAG GAL NAG 0.441558 0.673469
234 NAG GAL GAL NAG 0.441558 0.6875
235 MAN MAN MAN GLC 0.441176 1
236 GLA GLC 0.440678 1
237 LAK 0.440678 1
238 MLB 0.440678 1
239 BMA GLA 0.440678 1
240 GLA BMA 0.440678 1
241 BGC GLA 0.440678 1
242 MAN BMA 0.440678 1
243 GLA BGC 0.440678 1
244 GAL GAL 0.440678 1
245 BGC SGC BGC SGC BGC SGC BGC SGC 0.438356 0.916667
246 TM6 0.438356 0.916667
247 ABL 0.4375 0.702128
248 BMA FRU 0.435484 0.842105
249 FRU GAL 0.435484 0.842105
250 NOY BGC 0.435484 0.75
251 DAF GLC 0.434211 0.785714
252 DAF BGC 0.434211 0.785714
253 FUC GAL GLA 0.432836 0.970588
254 FUC GLA GLA 0.432836 0.970588
255 GAL GAL FUC 0.432836 0.970588
256 GLA GLA FUC 0.432836 0.970588
257 GLA GAL FUC 0.432836 0.970588
258 A2G GAL BGC FUC 0.428571 0.717391
259 BGC OXZ 0.428571 0.666667
260 ISX 0.428571 0.761905
261 BMA IFM 0.428571 0.744186
262 IFM BGC 0.428571 0.744186
263 VAM 0.428571 0.868421
264 9MR 0.428571 0.744186
265 IFM BMA 0.428571 0.744186
266 GLF B8D 0.428571 0.775
267 GLC GAL NAG GAL FUC FUC 0.426966 0.702128
268 7SA 0.426966 0.702128
269 BGC GAL NAG GAL FUC FUC 0.426966 0.702128
270 MAN MAN MAN BMA MAN 0.426667 1
271 GLC GLC GLC 0.42623 1
272 GLC GLC GLC GLC BGC 0.42623 1
273 GLC GLC GLC GLC GLC BGC 0.42623 1
274 MAN MAN MAN 0.42623 1
275 GLC GLC XYS XYS 0.422535 0.914286
276 GLC DMJ 0.421875 0.727273
277 BMA BMA BMA BMA GLA BMA GLA 0.420455 0.846154
278 GCS GCS 0.419355 0.804878
279 PA1 GCS 0.419355 0.804878
280 3SA 0.417722 0.733333
281 HMC AGL GLC 0.417722 0.717391
282 BGC 0.416667 0.848485
283 GLC 0.416667 0.848485
284 GLA 0.416667 0.848485
285 XZZ BGC BGC 0.416667 0.702128
286 6SA 0.416667 0.733333
287 GIV 0.416667 0.848485
288 GXL 0.416667 0.848485
289 BMA 0.416667 0.848485
290 ALL 0.416667 0.848485
291 WOO 0.416667 0.848485
292 MAN 0.416667 0.848485
293 GAL 0.416667 0.848485
294 HSD G6D GLC HSD G6D GLC BGC 0.41573 0.702128
295 ACI G6D GLC ACI G6D GLC GLC 0.41573 0.702128
296 HSD G6D GLC HSD G6D GLC GLC 0.41573 0.702128
297 ACI GLD GLC ACI GLD GLC ACI GLD GLC GLC 0.41573 0.702128
298 GAL NAG GAL 0.415584 0.702128
299 GCS GCS GCS GCS GCS GCS 0.415385 0.804878
300 GCS GCS GCS 0.415385 0.804878
301 GCS GCS GCS GCS GCS 0.415385 0.804878
302 P3M 0.414286 0.767442
303 MAN DGO 0.412698 0.914286
304 NAG NDG BMA 0.410256 0.634615
305 NAG NAG BMA 0.410256 0.634615
306 T6P 0.409836 0.767442
307 NAG MAN GAL MAN MAN NAG GAL 0.409091 0.6875
308 FUC BGC GAL NAG GAL 0.409091 0.717391
309 AMG 0.403846 0.857143
310 MBG 0.403846 0.857143
311 GYP 0.403846 0.857143
312 MMA 0.403846 0.857143
313 MAN 7D1 0.403226 0.888889
314 GAL MGC 0.402985 0.702128
315 GAL NGA A2G 0.402778 0.673469
316 MGL SGC BGC BGC 0.402299 0.622642
317 AGL GLC HMC AGL GLC BGC 0.402174 0.680851
318 FUC NDG GAL 0.4 0.717391
319 BGC BGC XYS BGC XYS GAL 0.4 0.916667
320 A2G GAL NAG FUC GAL GLC 0.4 0.673469
321 MBG A2G 0.4 0.702128
322 BGC BGC BGC XYS BGC XYS XYS GAL GAL 0.4 0.916667
323 GLC GAL NAG GAL FUC A2G 0.4 0.673469
324 AHR 0.4 0.742857
325 FUB 0.4 0.742857
326 A2G MBG 0.4 0.702128
327 RIB 0.4 0.742857
328 GAL NAG FUC 0.4 0.717391
329 BGC BGC XYS BGC BGC XYS XYS GAL GAL 0.4 0.916667
330 GAL NDG FUC 0.4 0.717391
331 32O 0.4 0.742857
332 FUC NAG GAL 0.4 0.717391
333 Z6J 0.4 0.742857
Ligand no: 2; Ligand: BMA BMA BMA BMA BMA BMA MAN; Similar ligands found: 288
No: Ligand ECFP6 Tc MDL keys Tc
1 BMA BMA BMA BMA BMA BMA MAN 1 1
2 MAN BMA BMA BMA BMA BMA 1 1
3 GLC GLC GLC GLC GLC GLC GLC GLC GLC 0.916667 0.970588
4 BGC BGC BGC GLC 0.916667 0.970588
5 MLR 0.916667 0.970588
6 BGC GLC GLC GLC GLC GLC GLC 0.916667 0.970588
7 MAN BMA BMA 0.916667 0.970588
8 MTT 0.916667 0.970588
9 BGC GLC GLC GLC 0.916667 0.970588
10 CT3 0.916667 0.970588
11 GAL GAL GAL 0.916667 0.970588
12 BGC BGC BGC BGC BGC BGC BGC BGC BGC 0.916667 0.970588
13 CE5 0.916667 0.970588
14 BGC BGC BGC BGC BGC BGC 0.916667 0.970588
15 BGC GLC GLC 0.916667 0.970588
16 BMA MAN BMA 0.916667 0.970588
17 BMA BMA BMA BMA BMA BMA 0.916667 0.970588
18 CE6 0.916667 0.970588
19 GLC BGC BGC BGC BGC 0.916667 0.970588
20 GLA GAL GLC 0.916667 0.970588
21 GLC GLC GLC GLC GLC GLC GLC GLC 0.916667 0.970588
22 GLC BGC GLC 0.916667 0.970588
23 GLC GLC BGC GLC GLC GLC GLC 0.916667 0.970588
24 GLC BGC BGC 0.916667 0.970588
25 GLC GLC BGC 0.916667 0.970588
26 CTT 0.916667 0.970588
27 MT7 0.916667 0.970588
28 BMA BMA BMA 0.916667 0.970588
29 BGC GLC GLC GLC GLC 0.916667 0.970588
30 DXI 0.916667 0.970588
31 GLC BGC BGC BGC BGC BGC 0.916667 0.970588
32 CEY 0.916667 0.970588
33 BMA BMA BMA BMA BMA 0.916667 0.970588
34 MAN BMA BMA BMA BMA 0.916667 0.970588
35 GLC GLC GLC GLC GLC GLC GLC 0.916667 0.970588
36 CEX 0.916667 0.970588
37 CTR 0.916667 0.970588
38 GLC GAL GAL 0.916667 0.970588
39 GLC GLC GLC GLC GLC 0.916667 0.970588
40 CE8 0.916667 0.970588
41 MAN MAN BMA BMA BMA BMA 0.916667 0.970588
42 B4G 0.916667 0.970588
43 LAT 0.833333 0.970588
44 MAB 0.833333 0.970588
45 N9S 0.833333 0.970588
46 LBT 0.833333 0.970588
47 GLC BGC 0.833333 0.970588
48 BGC GLC 0.833333 0.970588
49 CBI 0.833333 0.970588
50 B2G 0.833333 0.970588
51 GAL GLC 0.833333 0.970588
52 BMA GAL 0.833333 0.970588
53 BGC BMA 0.833333 0.970588
54 GLA GLA 0.833333 0.970588
55 GLA GAL 0.833333 0.970588
56 GAL BGC 0.833333 0.970588
57 MAL MAL 0.833333 1
58 MAL 0.833333 0.970588
59 CBK 0.833333 0.970588
60 BGC GAL 0.833333 0.970588
61 GLC GAL 0.833333 0.970588
62 BMA BMA 0.833333 0.970588
63 BGC BGC BGC BGC BGC BGC BGC BGC 0.77193 0.970588
64 BGC BGC BGC BGC 0.77193 0.970588
65 BMA BMA GLA BMA BMA 0.737705 0.970588
66 GLC GLC GLC BGC 0.721311 0.970588
67 BGC BGC GLC 0.714286 0.970588
68 LAT GLA 0.705882 0.970588
69 GLA GAL BGC 0.701754 0.970588
70 GLA GAL GAL 0.701754 0.970588
71 GLC GLC GLC GLC GLC GLC 0.688525 0.970588
72 BMA BMA MAN 0.642857 1
73 GLA EGA 0.631579 0.916667
74 NGA GAL BGC 0.61194 0.717391
75 XYS BGC BGC BGC BGC XYS BGC BGC BGC 0.611111 0.916667
76 XYS BGC BGC XYS BGC XYS BGC BGC BGC 0.611111 0.916667
77 BGC BGC BGC XYS BGC BGC 0.611111 0.916667
78 DR5 0.607143 0.916667
79 MMA MAN 0.607143 0.916667
80 GLA GAL BGC 5VQ 0.606557 0.868421
81 ABD 0.60274 0.733333
82 GAL NGA GLA BGC GAL 0.594595 0.717391
83 MAL EDO 0.59322 0.916667
84 GLC GLC XYP 0.584615 0.970588
85 GLC GLC BGC XYS BGC XYS 0.583333 0.916667
86 GLC BGC BGC BGC XYS BGC XYS XYS 0.578947 0.944444
87 G2F BGC BGC BGC BGC BGC 0.578125 0.846154
88 GLA GAL GLC NBU 0.578125 0.825
89 BGC BGC XYS BGC 0.577465 0.916667
90 LB2 0.571429 0.970588
91 MAN GLC 0.571429 0.970588
92 M3M 0.571429 0.970588
93 BGC BGC BGC XYS GAL 0.567568 0.916667
94 GLC GLC G6D ACI GLC GLC GLC 0.5625 0.767442
95 NGA GLA GAL BGC 0.56 0.717391
96 GAL FUC 0.559322 0.914286
97 U63 0.559322 0.868421
98 BGC BGC 0.553571 0.970588
99 MAN MAN 0.553571 0.970588
100 2M4 0.553571 0.970588
101 GLC GAL NAG GAL 0.546667 0.717391
102 BGC GLA GAL FUC 0.541667 0.942857
103 LAT NAG GAL 0.540541 0.717391
104 BGC GAL NAG GAL 0.540541 0.717391
105 GAL NAG GAL BGC 0.540541 0.717391
106 G2I 0.537313 0.75
107 FUC LAT 0.537313 0.942857
108 OXZ BGC BGC 0.537313 0.673469
109 BGC GAL FUC 0.537313 0.942857
110 FUC GAL GLC 0.537313 0.942857
111 GLC GAL FUC 0.537313 0.942857
112 G3I 0.537313 0.75
113 LAT FUC 0.537313 0.942857
114 BGC BGC G2F SHG 0.534247 0.871795
115 BGC BGC BGC 0.52459 0.970588
116 BGC BGC BGC ASO BGC BGC ASO 0.52459 0.970588
117 GLC BGC BGC BGC 0.52459 0.970588
118 BGC BGC BGC BGC BGC 0.52459 0.970588
119 BGC BGC BGC GLC BGC BGC 0.52459 0.970588
120 GLC BGC BGC BGC BGC BGC BGC 0.52459 0.970588
121 SGA BGC 0.52381 0.6875
122 GLC GLC XYS 0.521739 0.942857
123 BGC BGC BGC XYS BGC XYS GAL 0.518519 0.916667
124 GAL BGC BGC BGC XYS BGC XYS 0.518519 0.916667
125 ACR GLC GLC GLC 0.517647 0.717391
126 GLC GLC AGL HMC GLC 0.517647 0.717391
127 AAO 0.517647 0.717391
128 GLC GLC DAF BGC 0.517647 0.717391
129 GLC GLC ACI G6D GLC GLC 0.517647 0.717391
130 ARE 0.517647 0.717391
131 BMA MAN MAN 0.515625 0.970588
132 UMQ 0.514706 0.767442
133 LMT 0.514706 0.767442
134 LMU 0.514706 0.767442
135 DMU 0.514706 0.767442
136 SOR GLC GLC GLC 0.514286 0.942857
137 BGC BGC XYS BGC XYS BGC XYS 0.513158 0.916667
138 GLC BGC BGC XYS BGC XYS XYS 0.513158 0.916667
139 BGC BGC BGC XYS BGC XYS XYS 0.513158 0.916667
140 GLC ACI GLD GLC 0.5125 0.767442
141 GLC G6D ADH GLC 0.5125 0.767442
142 GLC G6D ACI GLC 0.5125 0.767442
143 GLC ACI G6D BGC 0.5125 0.767442
144 GLC GLC GLC G6D ADH GLC 0.511628 0.708333
145 NLC 0.507692 0.717391
146 5GO 0.507692 0.647059
147 NDG GAL 0.507692 0.717391
148 GAL NDG 0.507692 0.717391
149 GAL BGC BGC XYS 0.506849 0.916667
150 GLC GLC FRU 0.506849 0.846154
151 GAL BGC NAG GAL 0.506667 0.717391
152 BMA 0.5 0.823529
153 GXL 0.5 0.823529
154 GLA 0.5 0.823529
155 DEL 0.5 0.942857
156 BGC 0.5 0.823529
157 WOO 0.5 0.823529
158 ALL 0.5 0.823529
159 GIV 0.5 0.823529
160 MVP 0.5 0.717391
161 MAN 0.5 0.823529
162 GAL 0.5 0.823529
163 GLC 0.5 0.823529
164 BGC BGC XYS BGC GAL XYS BGC XYS GAL 0.494118 0.916667
165 GLC BGC BGC XYS BGC XYS XYS GAL 0.494118 0.916667
166 GAL BGC BGC BGC XYS XYS 0.494118 0.916667
167 GAL XYS XYS BGC BGC BGC XYS GAL BGC 0.494118 0.916667
168 GLC BGC BGC XYS BGC XYS XYS GAL GAL 0.494118 0.916667
169 NAG GAL BGC 0.493333 0.717391
170 6UZ 0.492958 0.825
171 MAN MAN BMA 0.492063 0.970588
172 BMA MAN 0.491803 0.888889
173 TRE 0.490196 0.970588
174 GAL GAL GLC EMB MEC 0.488372 0.611111
175 RCB 0.486486 0.611111
176 SOR GLC GLC 0.485714 0.942857
177 FUC BGC GAL 0.485294 0.942857
178 GLC AGL GLC HMC 0.476744 0.702128
179 GLC GLC GLC PO4 SGC GLC 0.47619 0.66
180 TXT 0.475 0.75
181 ACI GLD GLC GAL 0.475 0.767442
182 DAF GLC GLC 0.475 0.767442
183 GAC 0.475 0.75
184 DAF BGC GLC 0.475 0.767442
185 GLA MBG 0.474576 0.916667
186 GLO GLC GLC GLC 0.473684 0.916667
187 MAN NAG GAL 0.472973 0.717391
188 GAL NAG MAN 0.472973 0.717391
189 GLC ACI GLD GAL 0.470588 0.717391
190 QV4 0.470588 0.717391
191 GAL GAL SO4 0.470588 0.6875
192 GLC ACI G6D GLC 0.470588 0.717391
193 MAN MAN BMA MAN 0.464789 0.970588
194 MAN MAN MAN MAN 0.464789 0.970588
195 CM5 0.460526 0.868421
196 NPJ 0.459459 0.611111
197 BGC GLA 0.459016 0.970588
198 GLA BGC 0.459016 0.970588
199 GAL GAL 0.459016 0.970588
200 GLA BMA 0.459016 0.970588
201 MAN BMA 0.459016 0.970588
202 GLA GLC 0.459016 0.970588
203 MLB 0.459016 0.970588
204 LAK 0.459016 0.970588
205 BMA GLA 0.459016 0.970588
206 QPS 0.457831 0.717391
207 ACR 0.457831 0.717391
208 4MU BGC BGC BGC BGC 0.45679 0.75
209 NAG GAL GAL NAG GAL 0.455696 0.673469
210 MA4 0.454545 0.868421
211 BGC GLC AC1 GLC GLC GLC AC1 0.453488 0.733333
212 ACI G6D GLC ACI G6D BGC 0.453488 0.733333
213 ACI GLD GLC ACI G6D BGC 0.453488 0.733333
214 DAF GLC DAF GLC GLC 0.453488 0.733333
215 AC1 GLC AC1 BGC 0.453488 0.733333
216 ACI GLD GLC GLC GLC ACI GLD GLC GAL 0.453488 0.733333
217 LSE 0.452055 0.673469
218 GLO GLC GLC 0.447368 0.916667
219 GLA GAL NAG 0.445946 0.717391
220 10M 0.445946 0.717391
221 MAN BMA NAG 0.445946 0.717391
222 NAG GAL GAL 0.445946 0.717391
223 ACR GLC GLC GLC GLC 0.445783 0.717391
224 ACR GLC 0.445783 0.717391
225 4MU BGC BGC 0.444444 0.75
226 MAN MAN MAN 0.444444 0.970588
227 GLC GLC GLC GLC GLC BGC 0.444444 0.970588
228 GLC GLC GLC 0.444444 0.970588
229 DOM 0.444444 0.916667
230 GLC GLC GLC GLC BGC 0.444444 0.970588
231 GLC GLC GLC GLC 0.442857 0.970588
232 MGL SGC GLC GLC 0.441558 0.846154
233 BGC BGC SGC MGL 0.441558 0.846154
234 MAN MAN MAN BMA MAN 0.441558 0.970588
235 8VZ 0.441176 0.66
236 FMO 0.439394 0.846154
237 M5S 0.438356 0.970588
238 MAN BMA MAN MAN MAN 0.438356 0.970588
239 MAN MAN MAN GLC 0.43662 0.970588
240 GLA GAL NAG FUC GAL GLC 0.434783 0.702128
241 G6D GLC ACI GLD GLC ACI GLD GLC BGC 0.433333 0.666667
242 CGC 0.432836 0.914286
243 NOY BGC 0.430769 0.733333
244 5QP 0.430769 0.861111
245 RZM 0.428571 0.673913
246 MDM 0.428571 0.916667
247 ACG 0.428571 0.680851
248 GAL MBG 0.428571 0.916667
249 M13 0.428571 0.916667
250 6SA 0.428571 0.717391
251 FUC GAL NAG GAL BGC 0.426966 0.702128
252 GTM BGC BGC 0.426667 0.846154
253 MAN MNM 0.424242 0.733333
254 NAG BMA 0.422535 0.64
255 GAL A2G 0.42029 0.717391
256 A2G GAL 0.42029 0.717391
257 GAL NGA 0.42029 0.717391
258 NAG GAL GAL NAG 0.419753 0.673469
259 GAL NAG GAL NAG GAL NAG 0.419753 0.66
260 NOJ GLC 0.41791 0.711111
261 BMA BMA BMA BMA GLA BMA GLA 0.417582 0.871795
262 TM6 0.415584 0.891892
263 BGC SGC BGC SGC BGC SGC BGC SGC 0.415584 0.891892
264 DAF BGC 0.4125 0.767442
265 DAF GLC 0.4125 0.767442
266 ABL 0.411765 0.6875
267 P3M 0.410959 0.75
268 A2G GAL BGC FUC 0.409091 0.702128
269 FRU GAL 0.409091 0.820513
270 BMA FRU 0.409091 0.820513
271 7SA 0.408602 0.6875
272 BGC GAL NAG GAL FUC FUC 0.408602 0.6875
273 GLC GAL NAG GAL FUC FUC 0.408602 0.6875
274 GAL GAL FUC 0.408451 0.942857
275 FUC GAL GLA 0.408451 0.942857
276 FUC GLA GLA 0.408451 0.942857
277 GLA GLA FUC 0.408451 0.942857
278 GLA GAL FUC 0.408451 0.942857
279 IFM BGC 0.402985 0.727273
280 IFM BMA 0.402985 0.727273
281 ISX 0.402985 0.744186
282 VAM 0.402985 0.846154
283 BGC OXZ 0.402985 0.653061
284 GLF B8D 0.402985 0.756098
285 BMA IFM 0.402985 0.727273
286 9MR 0.402985 0.727273
287 GLC GLC XYS XYS 0.4 0.888889
288 GAL NGA A2G 0.4 0.693878
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5FU3; Ligand: BGC BGC BGC; Similar sites found: 122
This union binding pocket(no: 1) in the query (biounit: 5fu3.bio2) has 13 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3ZXE PGZ 0.0001977 0.47328 None
2 5H9Q TD2 0.00007521 0.44247 None
3 5DEY 59T 0.01944 0.4397 None
4 1WUB OTP 0.01745 0.43537 None
5 2X4Z X4Z 0.01754 0.4279 None
6 2X32 OTP 0.03155 0.42496 None
7 2Z77 HE7 0.01724 0.41708 None
8 2ABS ACP 0.03614 0.41596 None
9 4HN1 TYD 0.01541 0.40289 None
10 1TT8 PHB 0.03769 0.40103 None
11 2XMY CDK 0.003088 0.49244 1.88679
12 3RGA LSB 0.006459 0.42865 1.88679
13 1OGX EQU 0.003669 0.43959 2.83019
14 5HCY 60D 0.01835 0.4356 2.83019
15 5MZI FYK 0.03875 0.42871 2.83019
16 5MZI FAD 0.03782 0.42871 2.83019
17 1KGI T4A 0.03532 0.40093 2.83019
18 2YMZ LAT 0.0007398 0.44452 3.77358
19 1ZHX HC3 0.009165 0.43569 3.77358
20 4BVA T3 0.01744 0.43386 3.77358
21 5EOB 5QQ 0.048 0.41699 3.77358
22 3EKK GS2 0.03034 0.41684 3.77358
23 5CJ3 52G 0.03377 0.4096 3.77358
24 5LRT ADP 0.02603 0.40838 3.77358
25 2QK4 ATP 0.01579 0.40075 3.77358
26 5ML3 DL3 0.0005672 0.51224 4.71698
27 2DIO EOD 0.001764 0.45569 4.71698
28 5T7I LAT NAG GAL 0.001219 0.45005 4.71698
29 2QZ3 XYP XYP XYP 0.004855 0.44267 4.71698
30 4YLZ LAT NAG GAL 0.001965 0.43896 4.71698
31 1GT4 UNA 0.006921 0.42769 4.71698
32 1QY1 PRZ 0.009683 0.42755 4.71698
33 4KYS VIB 0.009053 0.41088 4.71698
34 2FB3 GTP 0.02986 0.41078 4.71698
35 4FFG 0U8 0.01042 0.40208 4.71698
36 2JIG PD2 0.0163 0.40068 4.71698
37 4IPH 1FJ 0.003649 0.45455 4.87805
38 3WG3 A2G GAL NAG FUC 0.0002628 0.48912 5.66038
39 2A4W BLM 0.007043 0.44312 5.66038
40 3F5K CE5 0.01118 0.43237 5.66038
41 1WW5 SGA BGC 0.003938 0.42465 5.66038
42 3SAO NKN 0.006244 0.42178 5.66038
43 2ZHL NAG GAL GAL NAG 0.0006739 0.42087 5.66038
44 3NV3 GAL NAG MAN 0.0003511 0.41843 5.66038
45 1N5S ADL 0.01095 0.41704 5.66038
46 1ZB6 GST 0.02455 0.4163 5.66038
47 1J3R 6PG 0.008428 0.41537 5.66038
48 3WV6 GAL BGC 0.0006315 0.40898 5.66038
49 4K3H 1OM 0.0264 0.40325 5.66038
50 4GCZ FMN 0.02776 0.40001 5.66038
51 3JRS A8S 0.01454 0.41368 5.76923
52 5DRB 5FJ 0.001152 0.506 6.60377
53 3ILR SGN IXD 0.002281 0.49389 6.60377
54 1T27 PCW 0.0104 0.44783 6.60377
55 3ILR SGN 0.02796 0.42694 6.60377
56 3ILR IXD 0.02796 0.42694 6.60377
57 3LVW GSH 0.02984 0.41667 6.60377
58 5IH9 6BF 0.03889 0.41009 6.60377
59 4RFR RHN 0.01824 0.40916 6.60377
60 4H2V AMP 0.0232 0.40812 6.60377
61 2YAK OSV 0.04033 0.40398 6.60377
62 4XV1 904 0.04833 0.40338 6.60377
63 5DQ8 FLF 0.04704 0.40234 6.60377
64 5I0U DCY 0.000573 0.47408 7.54717
65 1IF7 SBR 0.0118 0.47098 7.54717
66 4WVW SLT 0.00004311 0.46936 7.54717
67 1GP6 QUE 0.005982 0.4448 7.54717
68 1GP6 SIN 0.005602 0.4448 7.54717
69 1GP6 DH2 0.005602 0.4448 7.54717
70 2V58 LZJ 0.01985 0.43476 7.54717
71 4ZU4 4TG 0.006203 0.42966 7.54717
72 4ANW O92 0.01823 0.42583 7.54717
73 4P7X YCP 0.01005 0.42087 7.54717
74 4P7X AKG 0.01005 0.42087 7.54717
75 5W4W 9WG 0.02526 0.41498 7.54717
76 2D6M LBT 0.0006453 0.40872 7.54717
77 5BVE 4VG 0.01048 0.45963 8.49057
78 2WSA MYA 0.01795 0.45764 8.49057
79 2WSA 646 0.01795 0.45764 8.49057
80 2WT2 GAL NAG GAL NAG GAL NAG 0.005863 0.44364 8.49057
81 1S4M LUM 0.01476 0.42425 8.49057
82 2IFW ACE PHE LYS PHE PSA LEU AAR 0.02365 0.41834 8.49057
83 3WUC GLC GAL 0.0152 0.41523 8.49057
84 3G6K FAD 0.03862 0.40825 8.49057
85 3G6K POP 0.03519 0.40825 8.49057
86 4WUJ FMN 0.02385 0.40385 8.49057
87 4XBT 3ZQ 0.01848 0.40168 8.49057
88 3QCQ 3Q0 0.001425 0.52355 9.43396
89 5H9P TD2 0.0007289 0.46424 9.43396
90 5GLT BGC GAL NAG GAL 0.0001019 0.45436 9.43396
91 2YNE YNE 0.0351 0.43988 9.43396
92 2YNE NHW 0.0351 0.43988 9.43396
93 1GUI BGC BGC BGC BGC BGC BGC 0.004777 0.42312 9.43396
94 1I82 BGC BGC 0.005286 0.41835 9.43396
95 1EB1 ASP TYR GLU PRO ILE PRO GLU GLU ALA PHE 0.008931 0.41626 9.43396
96 2C49 ADN 0.02417 0.40204 10.3774
97 4H6B 10Y 0.001168 0.45967 11.3208
98 2E9L BGC 0.03572 0.41505 11.3208
99 4H6B 10X 0.01163 0.41201 11.3208
100 1IIU RTL 0.02209 0.40933 11.3208
101 3HQR OGA 0.01742 0.40133 11.3208
102 4OCT AKG 0.003864 0.40048 11.3208
103 4H69 10Y 0.001549 0.41418 12.2642
104 4UWJ 7L5 0.02167 0.44421 13.2075
105 4UWJ MYA 0.02167 0.44421 13.2075
106 3OYW TDG 0.002648 0.43663 13.2075
107 4Y24 TD2 0.003492 0.43615 13.2075
108 3N0Y APC 0.01586 0.4197 13.2075
109 4BR5 ANP 0.027 0.41801 13.2075
110 1QD1 FON 0.0309 0.40475 13.2075
111 3VQ2 LP4 LP5 MYR DAO 0.03343 0.42036 14.1509
112 2E56 MYR 0.03262 0.41068 14.1509
113 1SDW IYT 0.01437 0.40729 14.1509
114 2ZYI STE 0.03882 0.40114 14.1509
115 1NYW DAU 0.01093 0.4204 15.0943
116 2GJ5 VD3 0.0102 0.44426 16.0377
117 3PUR 2HG 0.008531 0.40812 16.0377
118 1SMR PIV HIS PRO PHE HIS LPL TYR TYR SER 0.02304 0.42419 16.9811
119 1MJJ HAL 0.01986 0.41466 16.9811
120 1GQG DCD 0.03123 0.40303 16.9811
121 4QJP V1F 0.03568 0.40174 18.8679
122 3FW9 SLX 0.0113 0.41975 25.4717
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