Receptor
PDB id Resolution Class Description Source Keywords
5J51 1.67 Å NON-ENZYME: BINDING STRUCTURE OF TETRAMERIC JACALIN COMPLEXED WITH GAL ALPHA-(1, AGGLUTININ ALPHA CHAIN ARTOCARPUS INTEGER
Ref.: EFFECT OF LINKAGE ON THE LOCATION OF REDUCING AND NONREDUCING SUGARS BOUND TO JACALIN. IUBMB LIFE V. 68 971 2016
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
GLA GLA E:213;
G:205;
Valid;
Valid;
none;
none;
submit data
342.297 n/a O(C1O...
EDO C:204;
E:208;
E:201;
E:204;
E:203;
C:208;
E:211;
E:206;
G:202;
G:204;
E:207;
E:209;
G:203;
C:206;
A:203;
C:202;
G:201;
C:207;
A:201;
E:210;
C:210;
E:205;
C:203;
C:201;
C:205;
C:209;
E:202;
A:202;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
62.068 C2 H6 O2 C(CO)...
IPA A:205;
B:101;
A:204;
C:211;
A:206;
E:212;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
submit data
60.095 C3 H8 O CC(C)...
PEG A:207;
Invalid;
none;
submit data
106.12 C4 H10 O3 C(COC...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1UGX 1.6 Å NON-ENZYME: BINDING CRYSTAL STRUCTURE OF JACALIN- ME-ALPHA-T-ANTIGEN (GAL-BETA(1 GALNAC-ALPHA-O-ME) COMPLEX ARTOCARPUS INTEGER ALL BETA SHEET PROTEIN BETA-PRISM I FOLD GALACTOSE-SPECIFIBINDING PROTEIN
Ref.: STRUCTURAL BASIS OF THE CARBOHYDRATE SPECIFICITIES JACALIN: AN X-RAY AND MODELING STUDY J.MOL.BIOL. V. 332 217 2003
Members (11)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 473 families.
1 4R6Q Ka = 77900 M^-1 NBZ GLA n/a n/a
2 5J4X - GAL MBG n/a n/a
3 4R6O Ka = 335000 M^-1 ZZ1 GLA n/a n/a
4 4R6N Ka = 150 M^-1 MBG C7 H14 O6 CO[C@H]1[C....
5 5JM1 - GLA GAL GAL n/a n/a
6 5J51 - GLA GLA n/a n/a
7 5J4T - NAG MBG n/a n/a
8 1UGX Ka = 806000 M^-1 GAL MGC n/a n/a
9 4R6P Ka = 12900 M^-1 ZZ1 GAL n/a n/a
10 1PXD Ka = 6500 M^-1 SFP C44 H34 N4 O12 S4 c1c(ccc(c1....
11 4R6R Ka = 2370 M^-1 147 C12 H15 N O8 c1cc(ccc1[....
70% Homology Family (19)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 355 families.
1 3LM1 Kd = 20 uM LEC C14 H18 N2 O8 CC(=O)N[C@....
2 4R6Q Ka = 77900 M^-1 NBZ GLA n/a n/a
3 5J4X - GAL MBG n/a n/a
4 4R6O Ka = 335000 M^-1 ZZ1 GLA n/a n/a
5 4R6N Ka = 150 M^-1 MBG C7 H14 O6 CO[C@H]1[C....
6 5JM1 - GLA GAL GAL n/a n/a
7 5J51 - GLA GLA n/a n/a
8 5J4T - NAG MBG n/a n/a
9 1UGX Ka = 806000 M^-1 GAL MGC n/a n/a
10 4R6P Ka = 12900 M^-1 ZZ1 GAL n/a n/a
11 1PXD Ka = 6500 M^-1 SFP C44 H34 N4 O12 S4 c1c(ccc(c1....
12 4R6R Ka = 2370 M^-1 147 C12 H15 N O8 c1cc(ccc1[....
13 4AKC - GAL A2G n/a n/a
14 4AKB - GAL C6 H12 O6 C([C@@H]1[....
15 1KUJ - MMA C7 H14 O6 CO[C@@H]1[....
16 1JOT - GAL A2G n/a n/a
17 1JAC - AMG C7 H14 O6 CO[C@@H]1[....
18 1M26 - GAL A2G n/a n/a
19 1TOQ - AMG C7 H14 O6 CO[C@@H]1[....
50% Homology Family (20)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 272 families.
1 3LLZ Kd = 16 uM GAL NGA n/a n/a
2 3LM1 Kd = 20 uM LEC C14 H18 N2 O8 CC(=O)N[C@....
3 4R6Q Ka = 77900 M^-1 NBZ GLA n/a n/a
4 5J4X - GAL MBG n/a n/a
5 4R6O Ka = 335000 M^-1 ZZ1 GLA n/a n/a
6 4R6N Ka = 150 M^-1 MBG C7 H14 O6 CO[C@H]1[C....
7 5JM1 - GLA GAL GAL n/a n/a
8 5J51 - GLA GLA n/a n/a
9 5J4T - NAG MBG n/a n/a
10 1UGX Ka = 806000 M^-1 GAL MGC n/a n/a
11 4R6P Ka = 12900 M^-1 ZZ1 GAL n/a n/a
12 1PXD Ka = 6500 M^-1 SFP C44 H34 N4 O12 S4 c1c(ccc(c1....
13 4R6R Ka = 2370 M^-1 147 C12 H15 N O8 c1cc(ccc1[....
14 4AKC - GAL A2G n/a n/a
15 4AKB - GAL C6 H12 O6 C([C@@H]1[....
16 1KUJ - MMA C7 H14 O6 CO[C@@H]1[....
17 1JOT - GAL A2G n/a n/a
18 1JAC - AMG C7 H14 O6 CO[C@@H]1[....
19 1M26 - GAL A2G n/a n/a
20 1TOQ - AMG C7 H14 O6 CO[C@@H]1[....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: GLA GLA; Similar ligands found: 339
No: Ligand ECFP6 Tc MDL keys Tc
1 LBT 1 1
2 GLC BGC 1 1
3 MAL MAL 1 0.970588
4 BGC GLC 1 1
5 CBI 1 1
6 GAL BGC 1 1
7 CBK 1 1
8 BGC BMA 1 1
9 N9S 1 1
10 GLA GLA 1 1
11 BGC GAL 1 1
12 GAL GLC 1 1
13 GLC GAL 1 1
14 BMA BMA 1 1
15 GLA GAL 1 1
16 BMA GAL 1 1
17 LAT 1 1
18 MAB 1 1
19 MAL 1 1
20 B2G 1 1
21 CEX 0.909091 1
22 BGC GLC GLC GLC GLC 0.909091 1
23 GLC GLC GLC GLC GLC 0.909091 1
24 CTR 0.909091 1
25 MTT 0.909091 1
26 CE5 0.909091 1
27 BMA BMA BMA BMA BMA 0.909091 1
28 CTT 0.909091 1
29 CT3 0.909091 1
30 GLC GLC GLC GLC GLC GLC GLC 0.909091 1
31 BGC GLC GLC GLC GLC GLC GLC 0.909091 1
32 BGC BGC BGC GLC 0.909091 1
33 CEY 0.909091 1
34 MAN MAN BMA BMA BMA BMA 0.909091 1
35 BMA BMA BMA 0.909091 1
36 B4G 0.909091 1
37 BGC BGC BGC BGC BGC BGC BGC BGC BGC 0.909091 1
38 GLC GAL GAL 0.909091 1
39 GLA GAL GLC 0.909091 1
40 GAL GAL GAL 0.909091 1
41 MAN BMA BMA BMA BMA 0.909091 1
42 MLR 0.909091 1
43 CE8 0.909091 1
44 MT7 0.909091 1
45 CE6 0.909091 1
46 GLC BGC BGC BGC BGC BGC 0.909091 1
47 GLC GLC BGC 0.909091 1
48 GLC BGC BGC 0.909091 1
49 GLC BGC GLC 0.909091 1
50 BMA MAN BMA 0.909091 1
51 GLC GLC BGC GLC GLC GLC GLC 0.909091 1
52 BGC GLC GLC 0.909091 1
53 BGC GLC GLC GLC 0.909091 1
54 GLC GLC GLC GLC GLC GLC GLC GLC GLC 0.909091 1
55 DXI 0.909091 1
56 BMA BMA BMA BMA BMA BMA 0.909091 1
57 GLC GLC GLC GLC GLC GLC GLC GLC 0.909091 1
58 GLC BGC BGC BGC BGC 0.909091 1
59 BGC BGC BGC BGC BGC BGC 0.909091 1
60 MAN BMA BMA 0.909091 1
61 MAN BMA BMA BMA BMA BMA 0.833333 0.970588
62 BMA BMA BMA BMA BMA BMA MAN 0.833333 0.970588
63 GLA GAL GAL 0.816327 1
64 GLA GAL BGC 0.816327 1
65 BGC BGC BGC BGC 0.754717 1
66 BGC BGC BGC BGC BGC BGC BGC BGC 0.754717 1
67 BMA BMA GLA BMA BMA 0.689655 1
68 LAT GLA 0.680851 1
69 GLC GLC GLC BGC 0.672414 1
70 BGC BGC GLC 0.660377 1
71 U63 0.647059 0.891892
72 DR5 0.64 0.942857
73 MMA MAN 0.64 0.942857
74 GLA EGA 0.634615 0.942857
75 BMA BMA MAN 0.615385 0.970588
76 GAL FUC 0.615385 0.941176
77 BGC BGC 0.612245 1
78 MAN MAN 0.612245 1
79 2M4 0.612245 1
80 GLC GAL FUC 0.610169 0.970588
81 GLC GLC GLC GLC GLC GLC 0.610169 1
82 FUC LAT 0.610169 0.970588
83 FUC GAL GLC 0.610169 0.970588
84 BGC GAL FUC 0.610169 0.970588
85 LAT FUC 0.610169 0.970588
86 BGC GLA GAL FUC 0.609375 0.970588
87 GAL NAG GAL BGC 0.606061 0.733333
88 LAT NAG GAL 0.606061 0.733333
89 GLC GLC BGC XYS BGC XYS 0.606061 0.942857
90 BGC GAL NAG GAL 0.606061 0.733333
91 MAN GLC 0.6 1
92 LB2 0.6 1
93 M3M 0.6 1
94 SGA BGC 0.6 0.702128
95 MAL EDO 0.592593 0.942857
96 BGC BGC BGC XYS GAL 0.588235 0.942857
97 XYS BGC BGC XYS BGC XYS BGC BGC BGC 0.588235 0.942857
98 GLC GAL NAG GAL 0.588235 0.733333
99 BGC BGC BGC XYS BGC BGC 0.588235 0.942857
100 XYS BGC BGC BGC BGC XYS BGC BGC BGC 0.588235 0.942857
101 NGA GAL BGC 0.587302 0.733333
102 TRE 0.581395 1
103 ABD 0.57971 0.75
104 NDG GAL 0.578947 0.733333
105 GAL NDG 0.578947 0.733333
106 5GO 0.578947 0.66
107 NLC 0.578947 0.733333
108 DEL 0.574074 0.970588
109 GAL NGA GLA BGC GAL 0.571429 0.733333
110 MVP 0.571429 0.733333
111 GAL BGC BGC XYS 0.569231 0.942857
112 GLC GLC FRU 0.569231 0.868421
113 BMA MAN 0.566038 0.914286
114 GLC GLC XYP 0.557377 1
115 BGC BGC XYS BGC 0.552239 0.942857
116 NAG GAL BGC 0.552239 0.733333
117 GLA GAL BGC 5VQ 0.551724 0.891892
118 G2F BGC BGC BGC BGC BGC 0.55 0.868421
119 GLA MBG 0.54902 0.942857
120 GLC ACI GLD GLC 0.547945 0.785714
121 GLC G6D ACI GLC 0.547945 0.785714
122 GLC ACI G6D BGC 0.547945 0.785714
123 GLC G6D ADH GLC 0.547945 0.785714
124 GLC BGC BGC BGC 0.545455 1
125 BGC BGC BGC ASO BGC BGC ASO 0.545455 1
126 GLC BGC BGC BGC BGC BGC BGC 0.545455 1
127 BGC BGC BGC 0.545455 1
128 BGC BGC BGC GLC BGC BGC 0.545455 1
129 BGC BGC BGC BGC BGC 0.545455 1
130 MAN MAN BMA 0.535714 1
131 NGA GLA GAL BGC 0.535211 0.733333
132 BMA MAN MAN 0.534483 1
133 GAL BGC BGC BGC XYS BGC XYS 0.533333 0.942857
134 BGC BGC BGC XYS BGC XYS GAL 0.533333 0.942857
135 GLC BGC BGC XYS BGC XYS XYS 0.528571 0.942857
136 BGC BGC BGC XYS BGC XYS XYS 0.528571 0.942857
137 BGC BGC XYS BGC XYS BGC XYS 0.528571 0.942857
138 GLA GAL GLC NBU 0.52459 0.846154
139 FUC BGC GAL 0.52459 0.970588
140 GLC ACI GLD GAL 0.519481 0.733333
141 GLC ACI G6D GLC 0.519481 0.733333
142 GLC GLC G6D ACI GLC GLC GLC 0.519481 0.785714
143 GLC BGC BGC BGC XYS BGC XYS XYS 0.513514 0.916667
144 DOM 0.509091 0.942857
145 GAL GAL SO4 0.508197 0.702128
146 DMU 0.507937 0.785714
147 LMT 0.507937 0.785714
148 LMU 0.507937 0.785714
149 G2I 0.507937 0.767442
150 G3I 0.507937 0.767442
151 OXZ BGC BGC 0.507937 0.6875
152 UMQ 0.507937 0.785714
153 GLC AGL GLC HMC 0.506329 0.717391
154 BGC BGC XYS BGC GAL XYS BGC XYS GAL 0.506329 0.942857
155 GLC BGC BGC XYS BGC XYS XYS GAL GAL 0.506329 0.942857
156 GAL BGC BGC BGC XYS XYS 0.506329 0.942857
157 GAL XYS XYS BGC BGC BGC XYS GAL BGC 0.506329 0.942857
158 GLC BGC BGC XYS BGC XYS XYS GAL 0.506329 0.942857
159 NAG GAL GAL 0.5 0.733333
160 SOR GLC GLC 0.5 0.970588
161 GAL GAL GLC EMB MEC 0.5 0.622642
162 FMO 0.5 0.868421
163 MAN BMA NAG 0.5 0.733333
164 GLA GAL NAG 0.5 0.733333
165 8VZ 0.5 0.673469
166 GLC GLC ACI G6D GLC GLC 0.493827 0.733333
167 GLC GLC AGL HMC GLC 0.493827 0.733333
168 GLC GLC DAF BGC 0.493827 0.733333
169 AAO 0.493827 0.733333
170 ARE 0.493827 0.733333
171 ACR GLC GLC GLC 0.493827 0.733333
172 GLC GLC XYS 0.492308 0.970588
173 CGC 0.491525 0.941176
174 5QP 0.491228 0.885714
175 MDM 0.490909 0.942857
176 RZM 0.490909 0.688889
177 M13 0.490909 0.942857
178 GAL MBG 0.490909 0.942857
179 GLC GLC GLC G6D ADH GLC 0.487805 0.6875
180 BGC BGC G2F SHG 0.485714 0.846154
181 MAN NAG GAL 0.485294 0.733333
182 GAL NAG MAN 0.485294 0.733333
183 6UZ 0.484848 0.846154
184 SOR GLC GLC GLC 0.484848 0.970588
185 LAG 0.484848 0.6
186 MAN MNM 0.482759 0.75
187 GAL BGC NAG GAL 0.478873 0.733333
188 10M 0.477612 0.733333
189 GTM BGC BGC 0.477612 0.868421
190 MAN MAN MAN MAN 0.476923 1
191 MAN MAN BMA MAN 0.476923 1
192 GLA GAL NAG FUC GAL GLC 0.47619 0.717391
193 NAG BMA 0.47619 0.653061
194 GAL NGA 0.47541 0.733333
195 GAL A2G 0.47541 0.733333
196 A2G GAL 0.47541 0.733333
197 BMA GLA 0.472727 1
198 LAK 0.472727 1
199 GAL GAL 0.472727 1
200 GLA GLC 0.472727 1
201 MLB 0.472727 1
202 GLA BMA 0.472727 1
203 BGC GLA 0.472727 1
204 MAN BMA 0.472727 1
205 GLA BGC 0.472727 1
206 NPJ 0.470588 0.622642
207 FUC GAL NAG GAL BGC 0.469136 0.717391
208 MAN MAN MAN GLC 0.46875 1
209 ABL 0.466667 0.702128
210 BMA FRU 0.465517 0.842105
211 FRU GAL 0.465517 0.842105
212 NOY BGC 0.465517 0.75
213 TM6 0.463768 0.916667
214 BGC SGC BGC SGC BGC SGC BGC SGC 0.463768 0.916667
215 LSE 0.462687 0.6875
216 GLA GLA FUC 0.460317 0.970588
217 FUC GAL GLA 0.460317 0.970588
218 GAL GAL FUC 0.460317 0.970588
219 GLA GAL FUC 0.460317 0.970588
220 FUC GLA GLA 0.460317 0.970588
221 DAF BGC 0.458333 0.785714
222 DAF GLC 0.458333 0.785714
223 IFM BMA 0.457627 0.744186
224 BGC OXZ 0.457627 0.666667
225 IFM BGC 0.457627 0.744186
226 BMA IFM 0.457627 0.744186
227 9MR 0.457627 0.744186
228 GLO GLC GLC 0.457143 0.942857
229 RCB 0.457143 0.622642
230 GLC GLC GLC GLC GLC BGC 0.45614 1
231 GLC GLC GLC 0.45614 1
232 GLC GLC GLC GLC BGC 0.45614 1
233 MAN MAN MAN 0.45614 1
234 GLC 0.454545 0.848485
235 BMA 0.454545 0.848485
236 GXL 0.454545 0.848485
237 WOO 0.454545 0.848485
238 GIV 0.454545 0.848485
239 GAL 0.454545 0.848485
240 MAN 0.454545 0.848485
241 BGC 0.454545 0.848485
242 ALL 0.454545 0.848485
243 GLA 0.454545 0.848485
244 GLC GLC GLC GLC 0.453125 1
245 MGL SGC GLC GLC 0.450704 0.868421
246 CM5 0.450704 0.891892
247 MAN MAN MAN BMA MAN 0.450704 1
248 BGC BGC SGC MGL 0.450704 0.868421
249 GLC DMJ 0.45 0.727273
250 A2G GAL BGC FUC 0.45 0.717391
251 GLC GLC GLC PO4 SGC GLC 0.45 0.673469
252 NOJ GLC 0.45 0.727273
253 PA1 GCS 0.448276 0.804878
254 GCS GCS 0.448276 0.804878
255 M5S 0.447761 1
256 MAN BMA MAN MAN MAN 0.447761 1
257 GLC GLC XYS XYS 0.447761 0.914286
258 DAF BGC GLC 0.447368 0.785714
259 TXT 0.447368 0.767442
260 GAC 0.447368 0.767442
261 DAF GLC GLC 0.447368 0.785714
262 ACI GLD GLC GAL 0.447368 0.785714
263 GLC GAL NAG GAL FUC FUC 0.447059 0.702128
264 BGC GAL NAG GAL FUC FUC 0.447059 0.702128
265 GAL NAG GAL NAG GAL NAG 0.445946 0.673469
266 NAG GAL GAL NAG GAL 0.445946 0.6875
267 NAG GAL GAL NAG 0.445946 0.6875
268 MA4 0.444444 0.891892
269 QV4 0.444444 0.733333
270 GLO GLC GLC GLC 0.444444 0.942857
271 MAN DGO 0.440678 0.914286
272 3SA 0.44 0.733333
273 Z6J 0.439024 0.742857
274 AHR 0.439024 0.742857
275 32O 0.439024 0.742857
276 FUB 0.439024 0.742857
277 RIB 0.439024 0.742857
278 T6P 0.438596 0.767442
279 GYP 0.4375 0.857143
280 AMG 0.4375 0.857143
281 MMA 0.4375 0.857143
282 MBG 0.4375 0.857143
283 4MU BGC BGC 0.434211 0.767442
284 ISX 0.433333 0.761905
285 MAN 7D1 0.431034 0.888889
286 QPS 0.43038 0.733333
287 ACR 0.43038 0.733333
288 4MU BGC BGC BGC BGC 0.428571 0.767442
289 GAL MGC 0.428571 0.702128
290 GAL NGA A2G 0.426471 0.673469
291 FUC NAG GAL 0.422535 0.717391
292 FUC NDG GAL 0.422535 0.717391
293 GAL NAG FUC 0.422535 0.717391
294 GAL NDG FUC 0.422535 0.717391
295 KHO 0.421053 0.888889
296 HMC AGL GLC 0.421053 0.717391
297 GCS GCS GCS GCS GCS 0.419355 0.804878
298 GCS GCS GCS GCS GCS GCS 0.419355 0.804878
299 GCS GCS GCS 0.419355 0.804878
300 GAL NAG GAL 0.418919 0.702128
301 GAL NGT 0.41791 0.66
302 P3M 0.41791 0.767442
303 NGT GAL 0.41791 0.66
304 ACR GLC GLC GLC GLC 0.417722 0.733333
305 ACR GLC 0.417722 0.733333
306 A2G GAL NAG FUC GAL GLC 0.417582 0.673469
307 GLC GAL NAG GAL FUC A2G 0.417582 0.673469
308 TUR 0.416667 0.842105
309 BTU 0.416667 0.842105
310 GLA MAN ABE 0.414286 0.916667
311 NAG NDG BMA 0.413333 0.634615
312 NAG NAG BMA 0.413333 0.634615
313 AHR AHR AHR 0.410714 0.857143
314 FUB AHR AHR 0.410714 0.857143
315 GLF B8D 0.409836 0.775
316 VAM 0.409836 0.868421
317 ACI G6D GLC ACI G6D BGC 0.409639 0.75
318 BGC GLC AC1 GLC GLC GLC AC1 0.409639 0.75
319 AC1 GLC AC1 BGC 0.409639 0.75
320 DAF GLC DAF GLC GLC 0.409639 0.75
321 ACI GLD GLC GLC GLC ACI GLD GLC GAL 0.409639 0.75
322 ACI GLD GLC ACI G6D BGC 0.409639 0.75
323 MAN MMA MAN 0.409091 0.942857
324 AHR AHR 0.407407 0.857143
325 FUB AHR 0.407407 0.857143
326 NAG BMA MAN MAN MAN MAN 0.407407 0.733333
327 G6D GLC ACI GLD GLC ACI GLD GLC BGC 0.406977 0.680851
328 4U0 0.406593 0.66
329 GLA MAN RAM ABE 0.405063 0.891892
330 BGC BGC SSG PIH 0.405063 0.767442
331 M1P 0.403846 0.697674
332 GL1 0.403846 0.697674
333 XGP 0.403846 0.697674
334 G1P 0.403846 0.697674
335 MAN IFM 0.403226 0.761905
336 GLC IFM 0.403226 0.761905
337 XZZ BGC BGC 0.402439 0.702128
338 ACG 0.402299 0.695652
339 FUC GAL 0.4 0.941176
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1UGX; Ligand: GAL MGC; Similar sites found: 279
This union binding pocket(no: 1) in the query (biounit: 1ugx.bio1) has 15 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1SS4 GSH 0.003298 0.48941 None
2 1VQ2 DDN 0.00001158 0.4867 None
3 4KCF AKM 0.0000112 0.47693 None
4 3ZZS TRP 0.000003289 0.47428 None
5 3ZZL TRP 0.00001459 0.46091 None
6 1Q3Q ANP 0.00009152 0.45389 None
7 2HMT NAI 0.00005791 0.45227 None
8 1O6B ADP 0.00005095 0.45063 None
9 4LBP 1WG 0.00001203 0.44734 None
10 2GJ3 FAD 0.000468 0.44281 None
11 2P4T NAP 0.00009917 0.42436 None
12 3F5O UOC COA 0.01703 0.41563 None
13 1QGQ UDP 0.01145 0.40023 None
14 1OD6 PNS 0.0001301 0.44428 1.50376
15 3DJL FAD 0.001736 0.42481 1.50376
16 2Q37 3AL 0.01676 0.41007 1.50376
17 3SHR CMP 0.01399 0.40015 1.50376
18 1RSD PSB 0.002962 0.44389 1.65289
19 1X1T NAD 0.00001044 0.49523 2.25564
20 1LO8 4CA 0.00002297 0.477 2.25564
21 1BDB NAD 0.00005171 0.47205 2.25564
22 1CFV E3G 0.0009473 0.40222 2.52101
23 3MB5 SAM 0.000001255 0.50697 3.00752
24 4Q0P 0MK 0.0001258 0.47094 3.00752
25 3CH5 GDP 0.0001482 0.42231 3.00752
26 2WIC GNP 0.00008193 0.41219 3.00752
27 2JEN GLC GLC XYS XYS 0.001076 0.40958 3.00752
28 3H86 AP5 0.001734 0.40458 3.00752
29 3S9K CIT 0.004392 0.49534 3.38983
30 4FR3 0V4 0.00000004674 0.57257 3.7594
31 4FR3 LYS ARG ARG LYS SEP VAL 0.00000005108 0.57128 3.7594
32 1GR0 NAD 0.000009213 0.49869 3.7594
33 3V91 UPG 0.000002272 0.49637 3.7594
34 1WVC CTP 0.0000262 0.48932 3.7594
35 1SAZ ACP 0.00003487 0.48081 3.7594
36 2E5V FAD 0.003236 0.47348 3.7594
37 2PN6 GLN 0.0001239 0.45939 3.7594
38 1GSA ADP 0.00003802 0.458 3.7594
39 1GSA GSH 0.00003608 0.45159 3.7594
40 4NVP 7CH 0.00004124 0.44166 3.7594
41 1N6B DMZ 0.0001145 0.43121 3.7594
42 2BW7 APC 0.0296 0.42508 3.7594
43 2BW7 ECS 0.02699 0.42508 3.7594
44 4IXW IXW 0.0054 0.4218 3.7594
45 1ONX ASP 0.0002002 0.41928 3.7594
46 4HPP GLU 0.0002771 0.41709 3.7594
47 1PN4 HDC 0.02017 0.41183 3.7594
48 3TWO NDP 0.03153 0.41092 3.7594
49 1F7K UMP 0.0001776 0.40975 3.7594
50 3NYQ MCA 0.03382 0.40615 3.7594
51 3NYQ AMP 0.03544 0.40615 3.7594
52 2YG3 FAD 0.04807 0.40568 3.7594
53 3LXI CAM 0.01321 0.40427 3.7594
54 4HZX G39 0.001302 0.40179 3.7594
55 1YBQ BDH 0.000973 0.40088 3.7594
56 2ZO9 MLI 0.000008892 0.52684 4.51128
57 1ZFJ IMP 0.00002182 0.49861 4.51128
58 1V5F TPP 0.0001646 0.485 4.51128
59 1V5F FAD 0.0001646 0.485 4.51128
60 2P2V CSF 0.000008322 0.48101 4.51128
61 1NVV GNP 0.00001704 0.47542 4.51128
62 1Z34 2FD 0.00002113 0.46931 4.51128
63 3QVL 5HY 0.00002719 0.46584 4.51128
64 1NVU GTP 0.0000341 0.46577 4.51128
65 2YYJ 4HP 0.0001176 0.46574 4.51128
66 2YYJ FAD 0.0001176 0.46574 4.51128
67 1I2B UPG 0.0004243 0.46335 4.51128
68 1I2B NAD 0.0004243 0.46335 4.51128
69 1I2B USQ 0.0004243 0.46335 4.51128
70 3F81 STT 0.005095 0.46032 4.51128
71 1PEA ACM 0.003744 0.45929 4.51128
72 1MVN PCO 0.00008617 0.45427 4.51128
73 4G87 UD1 0.0001649 0.43644 4.51128
74 1KW6 BPY 0.0004493 0.43484 4.51128
75 3M0J OAF 0.0001328 0.42069 4.51128
76 1WL4 COA 0.0004387 0.4206 4.51128
77 1JH7 UVC 0.0002954 0.4201 4.51128
78 1H6W SER LEU ASN TYR ILE ILE LYS VAL LYS GLU 0.001093 0.41363 4.51128
79 3ITJ FAD 0.04855 0.411 4.51128
80 1V25 ANP 0.03445 0.40785 4.51128
81 1RM4 NDP 0.0000002467 0.53904 5.26316
82 2R0N TGC 0.00003511 0.50234 5.26316
83 1EDO NAP 0.00001251 0.49095 5.26316
84 2R0N FAD 0.00005063 0.47819 5.26316
85 4AF0 IMP 0.00001873 0.46764 5.26316
86 1G41 ADP 0.00003368 0.46594 5.26316
87 2BGM NAJ 0.00009621 0.45319 5.26316
88 2NZ2 CIR 0.00001121 0.44146 5.26316
89 1VCO GLN 0.00001419 0.43824 5.26316
90 4M6T SAM 0.000108 0.43328 5.26316
91 3L8W XAN 0.00061 0.42732 5.26316
92 2FH5 GTP 0.0002789 0.42666 5.26316
93 2BJF DXC 0.0002572 0.4255 5.26316
94 4AF0 MOA 0.00003831 0.42182 5.26316
95 4P87 4NP 0.00006649 0.42067 5.26316
96 3EJ0 11X 0.0000541 0.42044 5.26316
97 1OFH ADP 0.0001348 0.40914 5.26316
98 2ZMF CMP 0.01665 0.40522 5.26316
99 2BGM MAX 0.0001696 0.40381 5.26316
100 2XBP ATP 0.001224 0.4093 5.30973
101 1GXU 2HP 0.0001101 0.44334 5.49451
102 3TA2 AKG 0.0002923 0.40764 5.9322
103 1EXB NDP 0.000003809 0.50984 6.01504
104 3EAU PDN 0.00001043 0.50001 6.01504
105 3EAU NDP 0.00001043 0.50001 6.01504
106 2C9O ADP 0.00001801 0.48569 6.01504
107 4JP3 CIT 0.000004102 0.46807 6.01504
108 4LTN NAI 0.00002562 0.46337 6.01504
109 4LTN FMN 0.00001803 0.46337 6.01504
110 1F8F NAD 0.00004675 0.46138 6.01504
111 1LGT BP3 0.0005011 0.46074 6.01504
112 3UC5 ATP 0.0000925 0.45464 6.01504
113 3K37 BCZ 0.0003183 0.44845 6.01504
114 3SUC ATP 0.00009102 0.43553 6.01504
115 1Z44 NPO 0.03196 0.43312 6.01504
116 3A8U PLP 0.00003385 0.42049 6.01504
117 4MOB COA 0.0003376 0.41835 6.01504
118 4I9A NCN 0.0001331 0.41742 6.01504
119 1G6O ADP 0.001125 0.41713 6.01504
120 1IZC PYR 0.00008263 0.40384 6.01504
121 4AP9 1PS 0.00003433 0.40379 6.01504
122 1JCM 137 0.0004216 0.40308 6.01504
123 4IEN COA 0.0007074 0.40304 6.01504
124 1A5Z NAD 0.02342 0.40277 6.01504
125 1I0S FMN 0.02482 0.40149 6.01504
126 1I0S NAP 0.03381 0.40149 6.01504
127 2NSJ C2R 0.0001066 0.46157 6.50888
128 1RP0 AHZ 0.000005029 0.50408 6.76692
129 1D7O TCL 0.00002858 0.48663 6.76692
130 1D7O NAD 0.00002858 0.48663 6.76692
131 1ME8 RVP 0.00003304 0.48306 6.76692
132 2IMP NAI 0.00007508 0.471 6.76692
133 4TMK T5A 0.0003819 0.46087 6.76692
134 1TV5 ORO 0.000176 0.45773 6.76692
135 4F8L GAL 0.01488 0.45219 6.76692
136 2X61 NGA GAL SIA 0.0001291 0.44907 6.76692
137 4GQB 0XU 0.0001777 0.44094 6.76692
138 2X61 CH 0.00007767 0.4389 6.76692
139 2H6B 3C4 0.000329 0.43423 6.76692
140 2P8B NSK 0.002202 0.4325 6.76692
141 2WLT ASP 0.00005824 0.42771 6.76692
142 1TV5 N8E 0.00145 0.41763 6.76692
143 1TV5 A26 0.000663 0.41763 6.76692
144 3AIQ HBO 0.0007334 0.41473 6.76692
145 16PK BIS 0.04267 0.40937 6.76692
146 2CDU ADP 0.01822 0.40144 6.76692
147 2BLE 5GP 0.000002573 0.506 7.5188
148 1V8K ANP 0.000003815 0.46543 7.5188
149 3OIG NAD 0.0001498 0.44873 7.5188
150 1V1A ADP 0.00001184 0.44754 7.5188
151 2FWP CIT 0.00001759 0.44616 7.5188
152 1DRV A3D 0.00009279 0.44585 7.5188
153 3ZPG 5GP 0.01321 0.43874 7.5188
154 3OIG IMJ 0.0001414 0.42291 7.5188
155 2QS8 MET 0.00009621 0.42147 7.5188
156 2QIA U20 0.001598 0.411 7.5188
157 3ZLB ANP 0.02458 0.40171 7.5188
158 1ZK4 NAP 0.00009583 0.46741 8.27068
159 1ZK4 AC0 0.00009583 0.46741 8.27068
160 3O03 NAP 0.00009542 0.4533 8.27068
161 4A8T PAO 0.0001998 0.44633 8.27068
162 4TSK NDP 0.0002872 0.43787 8.27068
163 1USF FMN 0.008671 0.43208 8.27068
164 1USF NAP 0.0103 0.43208 8.27068
165 1G7V PAI 0.0001456 0.43064 8.27068
166 3NJQ NJQ 0.00004908 0.42484 8.27068
167 2A0W DIH 0.0002136 0.41836 8.27068
168 4QN7 G39 0.0004841 0.40989 8.27068
169 3HU3 AGS 0.003139 0.40726 8.27068
170 1DXY NAD 0.00001703 0.4998 9.02256
171 4IVG ANP 0.00000262 0.49687 9.02256
172 1LTH NAD 0.00003087 0.46513 9.02256
173 2BNF UTP 0.00002773 0.45109 9.02256
174 1OMZ UD2 0.00006558 0.44607 9.02256
175 2BNE U5P 0.00004588 0.43804 9.02256
176 2Z5Y HRM 0.00003952 0.43254 9.02256
177 4Q3S X7A 0.0006132 0.41323 9.02256
178 4IAE 1DX 0.001499 0.41189 9.02256
179 3VKX T3 0.00007667 0.40067 9.02256
180 2XD9 XD9 0.0008342 0.45679 9.77444
181 1WKL ATP 0.0001233 0.44502 9.77444
182 1WKL ADP 0.0003345 0.42201 9.77444
183 2GGH NLQ 0.0001951 0.42161 9.77444
184 4B7J G39 0.0008078 0.40068 9.77444
185 4DA6 GA2 0.0000132 0.47897 10.5263
186 2RDT FMN 0.0002014 0.44106 10.5263
187 2ET1 GLV 0.00007316 0.43839 10.5263
188 2RDT 2RD 0.0005532 0.43489 10.5263
189 2ED4 FAD 0.00963 0.42973 10.5263
190 4MWV BCZ 0.0002549 0.42078 10.5263
191 4JEJ 1GP 0.01201 0.4041 10.5263
192 2GN2 C5P 0.00002009 0.40251 10.5263
193 2E1A MSE 0.001972 0.44023 10.6667
194 3CXO 1N5 0.000005901 0.45993 11.2782
195 2Q6K ADN 0.0002773 0.44842 11.2782
196 3CXO 3LR 0.000317 0.40663 11.2782
197 3Q3C NAD 0.0001161 0.44682 12.0301
198 3D2M COA 0.0007667 0.44577 12.0301
199 2BJU IH4 0.009328 0.43045 12.0301
200 2WL9 MBD 0.00007343 0.41187 12.0301
201 4CMF PXG 0.00002127 0.46813 12.782
202 4A3R CIT 0.00007647 0.43369 12.782
203 1I9G SAM 0.00000236 0.49329 13.5338
204 1R0X ATP 0.000007388 0.46057 13.5338
205 3C2O NTM 0.003827 0.41845 13.5338
206 3FSJ D7K 0.003929 0.40804 13.5338
207 1JA9 NDP 0.000001333 0.52322 14.2857
208 1YOE RIB 0.00000437 0.45994 14.2857
209 2NCD ADP 0.001309 0.45985 14.2857
210 1JA9 PYQ 0.00001019 0.4494 14.2857
211 3FPZ AHZ 0.0004139 0.4459 14.2857
212 3VGL BGC 0.00002273 0.43942 14.2857
213 3K9W 4PS 0.001094 0.43884 14.2857
214 3K9W ADE 0.001094 0.43884 14.2857
215 3VGL ANP 0.0001294 0.42961 14.2857
216 2Q1A 2KT 0.00005069 0.40893 14.2857
217 3CKZ ZMR 0.0001822 0.43008 15.0376
218 3O9L LPN 0.01961 0.42677 15.0376
219 2BTO GTP 0.0002793 0.42084 15.7407
220 4G1V FAD 0.0001607 0.46782 15.7895
221 1HV9 UD1 0.00007123 0.43012 15.7895
222 4FUA PGH 0.000073 0.41904 15.7895
223 1HV9 COA 0.0008033 0.415 15.7895
224 3E1T FAD 0.04457 0.40998 15.7895
225 2V3A FAD 0.04162 0.40732 15.7895
226 1FWY UD1 0.0006459 0.40216 15.7895
227 3MMR ABH 0.000008054 0.48585 16.5414
228 4C25 13P 0.00008578 0.42289 16.5414
229 3CL7 HYN 0.00004462 0.41656 16.5414
230 2F2U M77 0.003891 0.42292 17.2932
231 1RY2 AMP 0.0001188 0.41036 17.2932
232 3PLN U5P 0.006391 0.42364 18.0451
233 4HE2 AMP 0.00000374 0.46568 18.797
234 1K97 CIR 0.00007861 0.47169 20
235 1K97 ASP 0.00007861 0.47169 20
236 3MAG 3MA 0.002519 0.48557 20.3008
237 3UXL CFI 0.00009189 0.47326 20.3008
238 3KPE TM3 0.003408 0.44734 20.5128
239 4QN6 LNV 0.0001311 0.42945 23.3083
240 2BJK NAD 0.0004677 0.42802 23.3083
241 3Q2I HP7 0.002874 0.40852 23.3083
242 2Z9V PXM 0.001751 0.44808 24.0602
243 1E8G FAD 0.0009325 0.44074 25
244 1E8G FCR 0.001719 0.43049 25
245 4OE4 NAD 0.0002645 0.41124 25
246 1J2Z SOG 0.0001547 0.43568 27.8195
247 1AL8 DHP 0.00000717 0.49538 30
248 1AL8 FMN 0.000002919 0.49538 30
249 1LDM NAD 0.00003903 0.47122 30
250 1JQ5 NAD 0.0003312 0.46896 30
251 2OWZ F6P 0.00004563 0.44591 30
252 4OYA 1VE 0.002938 0.42535 30
253 2OWZ CIT 0.00001819 0.42314 30
254 1PJ6 FOL 0.0006983 0.41436 30
255 3FS8 ACO 0.008101 0.40421 30
256 3FS8 TDR 0.007172 0.40198 30
257 3R51 MMA 0.00003832 0.43115 34.5865
258 1P4C FMN 0.00002357 0.48014 35
259 1CR1 TTP 0.001475 0.42217 35
260 1V6A TRE 0.01088 0.41853 35
261 1D6H COA 0.03618 0.41494 35
262 3LL2 MAN MAN MAN MAN MAN MAN MAN MAN 0.004299 0.42569 37.3984
263 2GUC MAN 0.000008998 0.55721 37.7049
264 2HYQ MAN MAN 0.000003338 0.46354 37.7049
265 2HYR BGC GLC 0.000008551 0.43101 37.7049
266 2GUD MAN 0.00001031 0.42855 37.7049
267 2NU5 NAG 0.00001126 0.42771 37.7049
268 2NUO BGC 0.000018 0.42187 37.7049
269 2NLI LAC 0.00001527 0.47268 40
270 2NLI FMN 0.00001527 0.47268 40
271 1SAY PYR 0.001328 0.44424 40
272 3NOJ PYR 0.00001486 0.4354 40
273 2R7K AMZ 0.003047 0.42336 40
274 2R7K ACP 0.003047 0.42336 40
275 1JQN DCO 0.000109 0.40338 40
276 3VY6 BGC BGC 0.00003493 0.41457 40.6015
277 1T26 NAI 0.0003366 0.45611 45
278 1T26 GBD 0.0003366 0.45611 45
279 4CTA ATP 0.01333 0.41825 45
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