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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
- Family 90% : .ZIP | .CSV
- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1205 families. | |||||
1 | 2GUE | - | NAG | C8 H15 N O6 | CC(=O)N[C@.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1039 families. | |||||
1 | 2GUE | - | NAG | C8 H15 N O6 | CC(=O)N[C@.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | NGA | 1 | 1 |
2 | NAG | 1 | 1 |
3 | A2G | 1 | 1 |
4 | BM3 | 1 | 1 |
5 | HSQ | 1 | 1 |
6 | NDG | 1 | 1 |
7 | BGN | 0.638298 | 0.888889 |
8 | SIZ | 0.630435 | 0.906977 |
9 | YX1 | 0.625 | 0.65 |
10 | STZ | 0.612245 | 0.65 |
11 | 4QY | 0.591837 | 0.735849 |
12 | BMX | 0.591837 | 0.735849 |
13 | 16G | 0.591837 | 0.735849 |
14 | 9C1 | 0.58 | 0.886364 |
15 | SNG | 0.5625 | 0.866667 |
16 | NGS | 0.54902 | 0.661017 |
17 | NDG NAG | 0.54386 | 0.833333 |
18 | CBS | 0.54386 | 0.833333 |
19 | NAG GDL | 0.54386 | 0.833333 |
20 | CBS CBS | 0.54386 | 0.833333 |
21 | ASG | 0.538462 | 0.661017 |
22 | BG8 | 0.537037 | 0.906977 |
23 | MAG | 0.530612 | 0.909091 |
24 | 2F8 | 0.530612 | 0.909091 |
25 | NDG GAL | 0.517857 | 0.888889 |
26 | NLC | 0.517857 | 0.888889 |
27 | GAL NDG | 0.517857 | 0.888889 |
28 | NAG A2G | 0.517241 | 0.833333 |
29 | 4V5 | 0.517241 | 0.829787 |
30 | NAG NGA | 0.517241 | 0.833333 |
31 | 4UZ | 0.508475 | 0.808511 |
32 | NAG NAG NAG NAG NDG | 0.508197 | 0.816327 |
33 | NDG NAG NAG NAG | 0.508197 | 0.816327 |
34 | NAG NAG NDG | 0.508197 | 0.816327 |
35 | NAG NAG NDG NAG | 0.508197 | 0.816327 |
36 | CTO | 0.508197 | 0.816327 |
37 | NDG NAG NAG NDG | 0.508197 | 0.816327 |
38 | NAG NAG NAG NDG | 0.508197 | 0.816327 |
39 | NDG NAG NAG | 0.508197 | 0.816327 |
40 | NAG NAG NAG NAG NAG | 0.508197 | 0.816327 |
41 | NAG NAG NAG NAG NAG NAG | 0.508197 | 0.816327 |
42 | NAG NAG NAG NAG NAG NAG NAG NAG | 0.508197 | 0.816327 |
43 | MQG | 0.5 | 0.698113 |
44 | NBG | 0.5 | 0.951219 |
45 | GAL NGA | 0.491228 | 0.888889 |
46 | A2G GAL | 0.491228 | 0.888889 |
47 | GAL A2G | 0.491228 | 0.888889 |
48 | AMU | 0.490909 | 0.930233 |
49 | NG1 | 0.490566 | 0.754717 |
50 | GN1 | 0.490566 | 0.754717 |
51 | NAG GAL | 0.474576 | 0.888889 |
52 | GAL NAG | 0.474576 | 0.888889 |
53 | NAG FUC | 0.474576 | 0.866667 |
54 | NAG GAL NAG | 0.455882 | 0.833333 |
55 | 3YW | 0.448276 | 0.930233 |
56 | GLA GAL NAG | 0.446154 | 0.888889 |
57 | MAN BMA NAG | 0.446154 | 0.888889 |
58 | NGA GAL | 0.428571 | 0.869565 |
59 | FUC GAL NAG | 0.426471 | 0.869565 |
60 | GAL NAG FUC | 0.426471 | 0.869565 |
61 | DR2 | 0.426471 | 0.869565 |
62 | NAG GAL FUC | 0.426471 | 0.869565 |
63 | NDG GAL FUC | 0.426471 | 0.869565 |
64 | FUC GAL NDG | 0.426471 | 0.869565 |
65 | FUL GAL NAG | 0.426471 | 0.869565 |
66 | G6S NAG | 0.426471 | 0.645161 |
67 | TNR | 0.42623 | 0.833333 |
68 | GYU | 0.42623 | 0.740741 |
69 | GAL NGA A2G | 0.424242 | 0.833333 |
70 | NAG BDP | 0.421875 | 0.851064 |
71 | NAG MBG | 0.419355 | 0.851064 |
72 | NGA GAL BGC | 0.41791 | 0.888889 |
73 | NAG NDG | 0.415385 | 0.784314 |
74 | NAG NAG | 0.415385 | 0.784314 |
75 | AZC | 0.415094 | 0.795918 |
76 | SN5 SN5 | 0.412698 | 0.705882 |
77 | A2G MBG | 0.412698 | 0.851064 |
78 | MBG A2G | 0.412698 | 0.851064 |
79 | HS2 | 0.411765 | 0.8125 |
80 | 5AX | 0.411765 | 0.866667 |
81 | NAG MAN BMA | 0.411765 | 0.888889 |
82 | 6ZC | 0.409091 | 0.655738 |
83 | LEC | 0.409091 | 0.655738 |
84 | TCG | 0.408451 | 0.689655 |
85 | GAL BGC NAG GAL | 0.408451 | 0.888889 |
86 | NAG MAN | 0.40625 | 0.851064 |
87 | WOO | 0.404762 | 0.7 |
88 | MAN | 0.404762 | 0.7 |
89 | GAL | 0.404762 | 0.7 |
90 | BGC | 0.404762 | 0.7 |
91 | BMA | 0.404762 | 0.7 |
92 | GLA | 0.404762 | 0.7 |
93 | ALL | 0.404762 | 0.7 |
94 | GLC | 0.404762 | 0.7 |
95 | GXL | 0.404762 | 0.7 |
96 | GIV | 0.404762 | 0.7 |
97 | NAG AMU | 0.402778 | 0.8 |
98 | NAG MUB | 0.402778 | 0.8 |
99 | NAG A2G GAL | 0.402778 | 0.833333 |
100 | A2G GAL FUC | 0.4 | 0.869565 |
101 | FUC GLA A2G | 0.4 | 0.869565 |
102 | DR3 | 0.4 | 0.869565 |
103 | A2G GLA FUC | 0.4 | 0.869565 |
104 | NGA GAL FUC | 0.4 | 0.869565 |
105 | FUC GAL A2G | 0.4 | 0.869565 |
This union binding pocket(no: 1) in the query (biounit: 2gue.bio1) has 7 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 2BQP | GLC | None |
2 | 2GJ5 | VD3 | None |
3 | 1OFS | SUC | None |
4 | 1LES | GLC FRU | None |
5 | 4RFM | 3P6 | None |
6 | 4AG9 | COA | None |
7 | 2CVQ | NDP | 1.63934 |
8 | 3GD4 | NAD | 2.45902 |
9 | 3GD4 | FAD | 2.45902 |
10 | 2JE7 | XMM | 2.45902 |
11 | 3LOO | B4P | 2.45902 |
12 | 3RFV | NAI | 2.45902 |
13 | 3RFV | 15L | 2.45902 |
14 | 1PN0 | IPH | 3.27869 |
15 | 1Q1R | FAD | 3.27869 |
16 | 1PZG | A3D | 3.27869 |
17 | 1PN0 | FAD | 3.27869 |
18 | 3RG9 | NDP | 3.27869 |
19 | 3RG9 | WRA | 3.27869 |
20 | 2GZ3 | NAP | 3.27869 |
21 | 5BUK | FAD | 4.09836 |
22 | 6FFI | D8B | 4.09836 |
23 | 5ZYN | FAD | 4.09836 |
24 | 4U8P | UDP | 4.09836 |
25 | 1SOW | NAD | 4.09836 |
26 | 1YKJ | PHB | 4.09836 |
27 | 1YKJ | FAD | 4.09836 |
28 | 4YKG | NAD | 4.09836 |
29 | 4U8P | FDA | 4.09836 |
30 | 4EUU | BX7 | 4.09836 |
31 | 5M67 | 3D1 | 4.09836 |
32 | 5M67 | NAD | 4.09836 |
33 | 3A4V | NAD | 4.09836 |
34 | 3A4V | PYR | 4.09836 |
35 | 3TKY | SAH | 4.09836 |
36 | 3ZG6 | APR | 4.09836 |
37 | 5AWM | ANP | 4.09836 |
38 | 3VPH | NAD | 4.19355 |
39 | 3VPH | OXM | 4.19355 |
40 | 4KGD | TDP | 4.91803 |
41 | 4KGD | FAD | 4.91803 |
42 | 4K5S | FAD | 4.91803 |
43 | 4K5S | PM0 | 4.91803 |
44 | 4EMI | NAD | 4.91803 |
45 | 4EMI | FAD | 4.91803 |
46 | 5VN0 | NAI | 4.91803 |
47 | 1ZEM | NAD | 4.91803 |
48 | 4O4F | ATP | 4.91803 |
49 | 4O4F | IHP | 4.91803 |
50 | 3EYA | TDP | 4.91803 |
51 | 2CYB | TYR | 4.91803 |
52 | 3B20 | NAD | 4.91803 |
53 | 3L4S | 3PG | 4.91803 |
54 | 1LVK | MNT BEF | 5.7377 |
55 | 2C80 | GTX | 5.7377 |
56 | 4O33 | 3PG | 5.7377 |
57 | 4O33 | TZN | 5.7377 |
58 | 3CGD | COA | 5.7377 |
59 | 3CGD | NAD | 5.7377 |
60 | 3CGD | FAD | 5.7377 |
61 | 4U36 | TNR | 5.7377 |
62 | 1LUA | NAP | 5.7377 |
63 | 5G3U | ITW | 5.7377 |
64 | 5G3U | FDA | 5.7377 |
65 | 5WKC | FAD | 5.7377 |
66 | 3QV1 | NAD | 5.7377 |
67 | 1TUU | ADP | 5.7377 |
68 | 4BX7 | B4F | 5.7377 |
69 | 6C2Z | P1T | 5.7377 |
70 | 3K5I | AIR | 5.95534 |
71 | 2GNM | MAN | 6.55738 |
72 | 2PHU | MAN MAN | 6.55738 |
73 | 2GN3 | MAN | 6.55738 |
74 | 2GNB | MAN | 6.55738 |
75 | 2PHF | MAN MAN | 6.55738 |
76 | 5EYY | MDM | 6.55738 |
77 | 1UKG | MMA | 6.55738 |
78 | 1Q8Q | MAN MMA | 6.55738 |
79 | 2GN3 | MMA | 6.55738 |
80 | 2PHT | MAN MAN MAN | 6.55738 |
81 | 2PHF | MAN MAN BMA MAN | 6.55738 |
82 | 2PHT | MAN MAN MAN BMA MAN | 6.55738 |
83 | 3SQP | FAD | 6.55738 |
84 | 2PHU | MAN MAN MAN BMA MAN | 6.55738 |
85 | 2GMM | MAN MAN | 6.55738 |
86 | 1LOF | MAN BMA NAG NAG MAN NAG GAL GAL | 6.55738 |
87 | 2AUY | NAG MAN MMA | 6.55738 |
88 | 2AR6 | NAG MAN MAN MAN NAG | 6.55738 |
89 | 1Q8S | MAN MMA | 6.55738 |
90 | 2AR6 | NAG MAN | 6.55738 |
91 | 2YVF | FAD | 6.55738 |
92 | 1B8O | IMH | 6.55738 |
93 | 2GND | MAN | 6.55738 |
94 | 3NKS | FAD | 6.55738 |
95 | 2PHX | MAN MAN | 6.55738 |
96 | 1Q8V | MAN MAN | 6.55738 |
97 | 3ZYR | NAG NAG BMA MAN MAN NAG NAG | 6.55738 |
98 | 1Q8O | MAN MMA | 6.55738 |
99 | 2R4J | FAD | 6.55738 |
100 | 2R4J | 13P | 6.55738 |
101 | 1GUZ | NAD | 6.55738 |
102 | 1Q8V | MAN MAN MAN | 6.55738 |
103 | 2PHW | MAN MAN | 6.55738 |
104 | 2GND | MAN MMA | 6.55738 |
105 | 2PHR | MAN MAN | 6.55738 |
106 | 2PHX | MAN MAN MAN MAN | 6.55738 |
107 | 1Q8P | MAN MMA | 6.55738 |
108 | 3ZYR | ASN NAG NAG BMA MAN MAN NAG NAG | 6.55738 |
109 | 2HJR | APR | 6.55738 |
110 | 2GMP | NAG MAN | 6.55738 |
111 | 1L3I | SAH | 6.55738 |
112 | 5YLT | SFG | 6.55738 |
113 | 2PHR | MAN MAN BMA MAN | 6.55738 |
114 | 6F3M | NAD | 6.55738 |
115 | 1QAN | SAH | 6.55738 |
116 | 2PHW | MAN MAN MAN BMA MAN MAN MAN | 6.55738 |
117 | 5A1S | FLC | 6.55738 |
118 | 2D3S | TNR | 6.55738 |
119 | 5LD5 | NAD | 6.55738 |
120 | 2WPX | ACO | 6.55738 |
121 | 4USQ | FAD | 6.55738 |
122 | 5NUF | NAD | 6.55738 |
123 | 1LOB | MMA | 6.55738 |
124 | 5NUE | NAD | 6.55738 |
125 | 4O0L | NDP | 6.55738 |
126 | 3RDO | BTN | 6.55738 |
127 | 1BXG | NAD | 7.37705 |
128 | 1O2D | NAP | 7.37705 |
129 | 1VHD | NAP | 7.37705 |
130 | 5J60 | FAD | 7.37705 |
131 | 2IHU | TP9 | 7.37705 |
132 | 2RGO | FAD | 7.37705 |
133 | 5JY6 | NAD | 7.37705 |
134 | 1UPA | TPP | 7.37705 |
135 | 1RVV | INI | 7.37705 |
136 | 4RPL | 3UC | 7.37705 |
137 | 4RPL | FAD | 7.37705 |
138 | 1RRM | APR | 7.37705 |
139 | 1RYI | FAD | 8.19672 |
140 | 1RYI | GOA | 8.19672 |
141 | 5MDH | NAD | 8.19672 |
142 | 5B47 | PYR | 8.19672 |
143 | 5B47 | TPP | 8.19672 |
144 | 2WA2 | SAM | 8.19672 |
145 | 3EI9 | PL6 | 8.19672 |
146 | 1D7O | TCL | 8.19672 |
147 | 1D7O | NAD | 8.19672 |
148 | 2WPU | KYT | 8.19672 |
149 | 4MDH | NAD | 8.19672 |
150 | 5BRT | CH9 | 8.19672 |
151 | 3UZO | GLU | 8.19672 |
152 | 4M00 | SUC | 8.19672 |
153 | 1GPM | CIT | 8.19672 |
154 | 5ZZ6 | NAD | 8.19672 |
155 | 5KOX | RFP | 9.01639 |
156 | 5KOX | FAD | 9.01639 |
157 | 4AP3 | NAP | 9.01639 |
158 | 4AP3 | FAD | 9.01639 |
159 | 2A92 | NAI | 9.01639 |
160 | 5J5Z | FAD | 9.01639 |
161 | 4PLG | OXM | 9.01639 |
162 | 4PLG | NAI | 9.01639 |
163 | 3KJS | NAP | 9.01639 |
164 | 2Y6Q | I7T | 9.01639 |
165 | 2Y6Q | FAD | 9.01639 |
166 | 4IV9 | FAD | 9.01639 |
167 | 1QL9 | ZEN | 9.01639 |
168 | 1KAO | GDP | 9.58084 |
169 | 3AD8 | NAD | 9.83607 |
170 | 1NVM | NAD | 9.83607 |
171 | 1T26 | GBD | 9.83607 |
172 | 1T26 | NAI | 9.83607 |
173 | 5LA1 | XYP | 9.83607 |
174 | 1XI9 | PLP | 9.83607 |
175 | 1U6R | ADP | 9.83607 |
176 | 3PFD | FDA | 9.83607 |
177 | 2YVJ | NAI | 10.0917 |
178 | 1MVQ | MMA | 10.6557 |
179 | 1D4D | FAD | 10.6557 |
180 | 5ZAI | COA | 10.6557 |
181 | 1VRP | ADP | 10.6557 |
182 | 4EHU | ANP | 10.6557 |
183 | 3B6R | ADP | 10.6557 |
184 | 1D09 | PAL | 10.6557 |
185 | 4USR | FAD | 11.4754 |
186 | 4Z0H | NAD | 11.4754 |
187 | 4DSG | FAD | 11.4754 |
188 | 4DSG | UDP | 11.4754 |
189 | 1PFK | ADP | 11.4754 |
190 | 3P9C | SAH | 11.4754 |
191 | 1SAY | PYR | 12.2951 |
192 | 1H9A | NAP | 12.2951 |
193 | 1BW9 | NAD | 13.1148 |
194 | 5X68 | FAD | 13.1148 |
195 | 1C1X | NAD | 13.1148 |
196 | 2AG8 | NAP | 13.1148 |
197 | 3KDN | CAP | 13.1148 |
198 | 1KYZ | SAH | 13.1148 |
199 | 1I9G | SAM | 13.9344 |
200 | 4PLT | NAI | 13.9344 |
201 | 4PLT | OXM | 13.9344 |
202 | 5Y1G | NAD | 13.9344 |
203 | 5Y1G | AKB | 13.9344 |
204 | 1LTH | NAD | 13.9344 |
205 | 2Q7V | FAD | 14.7541 |
206 | 4EKV | BTN | 14.7541 |
207 | 2Z3Y | F2N | 14.7541 |
208 | 1XPM | HMG | 14.7541 |
209 | 1XPM | CAA | 14.7541 |
210 | 1TZJ | A3B | 14.7541 |
211 | 3AXB | FAD | 15.5738 |
212 | 3AXB | PRO | 15.5738 |
213 | 2QA1 | FAD | 16.3934 |
214 | 3JQ3 | ADP | 17.2131 |
215 | 4BV6 | FAD | 18.8525 |
216 | 5V6F | MAN BMA MAN | 19.6721 |
217 | 1FNZ | A2G | 19.6721 |
218 | 2FMD | MAN MAN | 20.4918 |
219 | 1ELI | PYC | 21.3115 |
220 | 2GN4 | UD1 | 21.3115 |
221 | 6GNA | FAD | 21.3115 |
222 | 1XXR | MAN | 23.7705 |
223 | 1VBO | MAN | 24.5902 |
224 | 1VBO | MAN MAN MAN | 24.5902 |
225 | 1JOT | GAL A2G | 24.5902 |
226 | 5IN4 | NAP | 24.5902 |
227 | 2PEL | LBT | 24.5902 |
228 | 5IN4 | GDP | 24.5902 |
229 | 5IN4 | 6CK | 24.5902 |
230 | 2PEL | LAT | 24.5902 |
231 | 1KPG | SAH | 26.2295 |
232 | 1C3M | MAN MAN | 34.4262 |
233 | 1WS5 | MMA | 37.7049 |
234 | 1WS4 | AMG | 37.7049 |
235 | 1WS4 | GYP | 37.7049 |
236 | 1KUJ | MMA | 37.7049 |
237 | 5Z75 | NAD | 37.7049 |
238 | 1UGY | GLA BGC | 37.7049 |
239 | 1UGY | GLA GLC | 37.7049 |
240 | 1UGW | GAL | 37.7049 |
241 | 1UGX | GAL MGC | 37.7049 |
242 | 1M26 | GAL A2G | 37.7049 |
243 | 1JAC | AMG | 37.7049 |
244 | 1TOQ | AMG | 40.1639 |
245 | 6FLZ | MMA | 45.082 |
246 | 2BMZ | XLM | 48.3607 |