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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 261 families. | |||||
1 | 4GSU | - | DWZ | C17 H27 N3 O5 S | C[C@H]1[C@.... |
2 | 3TUR | - | 6CL | C7 H15 N2 O4 | C(C[C@H](C.... |
3 | 5DVP | - | POA | C2 H5 O4 P | C(C=O)P(=O.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 214 families. | |||||
1 | 4GSU | - | DWZ | C17 H27 N3 O5 S | C[C@H]1[C@.... |
2 | 3TUR | - | 6CL | C7 H15 N2 O4 | C(C[C@H](C.... |
3 | 5DVP | - | POA | C2 H5 O4 P | C(C=O)P(=O.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | CHT | 1.0000 |
2 | COM | 1.0000 |
3 | 2HE | 0.9993 |
4 | TAU | 0.9988 |
5 | P7I | 0.9972 |
6 | ETM | 0.9899 |
7 | XPO | 0.9863 |
8 | 8X3 | 0.9862 |
9 | 9SB | 0.9860 |
10 | VX | 0.9860 |
11 | EFS | 0.9830 |
12 | OPE | 0.9670 |
13 | HSW | 0.9666 |
14 | FCN | 0.9661 |
15 | BTL | 0.9649 |
16 | PCT | 0.9616 |
17 | CP | 0.9581 |
18 | 1Y8 | 0.9568 |
19 | IVA | 0.9565 |
20 | PAE | 0.9549 |
21 | MLA | 0.9548 |
22 | FJO | 0.9544 |
23 | PGA | 0.9538 |
24 | MLI | 0.9536 |
25 | S0H | 0.9523 |
26 | PPF | 0.9505 |
27 | ODV | 0.9493 |
28 | 3HR | 0.9474 |
29 | TB6 | 0.9445 |
30 | TB0 | 0.9436 |
31 | MLM | 0.9427 |
32 | 1AC | 0.9426 |
33 | TAY | 0.9421 |
34 | 7VD | 0.9418 |
35 | A20 | 0.9414 |
36 | MPD | 0.9410 |
37 | SAT | 0.9403 |
38 | ETF | 0.9402 |
39 | 3HL | 0.9401 |
40 | VSO | 0.9395 |
41 | BU4 | 0.9382 |
42 | FW5 | 0.9382 |
43 | P2D | 0.9374 |
44 | MMQ | 0.9370 |
45 | AKB | 0.9339 |
46 | DMG | 0.9334 |
47 | DSS | 0.9332 |
48 | HV2 | 0.9322 |
49 | SER | 0.9309 |
50 | BUA | 0.9304 |
51 | BAE | 0.9286 |
52 | CNH | 0.9272 |
53 | THR | 0.9260 |
54 | 8FH | 0.9255 |
55 | ALO | 0.9243 |
56 | BAL | 0.9242 |
57 | BUB | 0.9237 |
58 | AAE | 0.9226 |
59 | MRY | 0.9218 |
60 | SSN | 0.9218 |
61 | ABU | 0.9206 |
62 | 1SP | 0.9206 |
63 | TAN | 0.9204 |
64 | MAE | 0.9185 |
65 | SGL | 0.9165 |
66 | BUQ | 0.9162 |
67 | BMD | 0.9159 |
68 | 192 | 0.9158 |
69 | VAL | 0.9154 |
70 | AOA | 0.9140 |
71 | PRO | 0.9140 |
72 | LEA | 0.9137 |
73 | 3OH | 0.9134 |
74 | MTG | 0.9131 |
75 | CYS | 0.9131 |
76 | DSN | 0.9130 |
77 | ITU | 0.9124 |
78 | HLT | 0.9123 |
79 | IPU | 0.9118 |
80 | LER | 0.9111 |
81 | GOL | 0.9106 |
82 | DE2 | 0.9094 |
83 | KIV | 0.9091 |
84 | IHG | 0.9089 |
85 | SIN | 0.9083 |
86 | HIU | 0.9069 |
87 | SAR | 0.9066 |
88 | GG6 | 0.9066 |
89 | BXO | 0.9060 |
90 | 3PP | 0.9053 |
91 | DTL | 0.9046 |
92 | 39J | 0.9045 |
93 | 3PY | 0.9043 |
94 | PUT | 0.9042 |
95 | MSF | 0.9040 |
96 | DXX | 0.9039 |
97 | X1S | 0.9039 |
98 | XAP | 0.9039 |
99 | TFS | 0.9038 |
100 | 4MV | 0.9037 |
101 | C5J | 0.9030 |
102 | A8C | 0.9028 |
103 | ISU | 0.9027 |
104 | EGD | 0.9024 |
105 | SMB | 0.9020 |
106 | HDA | 0.9016 |
107 | 1SH | 0.9016 |
108 | ETX | 0.9015 |
109 | KG7 | 0.9015 |
110 | DGY | 0.9011 |
111 | 03W | 0.9011 |
112 | TFB | 0.9008 |
113 | C2N | 0.9008 |
114 | NMG | 0.9004 |
115 | SLP | 0.9002 |
116 | PRS | 0.9000 |
117 | D2P | 0.9000 |
118 | PYR | 0.8998 |
119 | 2MH | 0.8997 |
120 | 4JU | 0.8997 |
121 | 2KT | 0.8996 |
122 | DCY | 0.8995 |
123 | HSE | 0.8984 |
124 | A3B | 0.8983 |
125 | ABA | 0.8983 |
126 | OXL | 0.8983 |
127 | FLA | 0.8980 |
128 | ASP | 0.8979 |
129 | ILE | 0.8979 |
130 | PE9 | 0.8978 |
131 | 2OP | 0.8974 |
132 | OXM | 0.8974 |
133 | HUI | 0.8972 |
134 | ALA | 0.8970 |
135 | 2RA | 0.8968 |
136 | HX2 | 0.8965 |
137 | HCS | 0.8960 |
138 | PRI | 0.8960 |
139 | DCL | 0.8959 |
140 | 4HA | 0.8950 |
141 | OXD | 0.8946 |
142 | HBR | 0.8945 |
143 | LAC | 0.8944 |
144 | T2C | 0.8941 |
145 | 9X7 | 0.8939 |
146 | FMS | 0.8933 |
147 | DPR | 0.8929 |
148 | 2PC | 0.8929 |
149 | ICN | 0.8923 |
150 | POP | 0.8914 |
151 | 3BB | 0.8912 |
152 | LLQ | 0.8911 |
153 | FUM | 0.8905 |
154 | 9YL | 0.8903 |
155 | DBB | 0.8901 |
156 | PPV | 0.8897 |
157 | HBS | 0.8892 |
158 | SMV | 0.8887 |
159 | NAK | 0.8885 |
160 | PAH | 0.8884 |
161 | 3GR | 0.8880 |
162 | ALQ | 0.8871 |
163 | NCM | 0.8870 |
164 | PPI | 0.8869 |
165 | 2PN | 0.8859 |
166 | CXL | 0.8858 |
167 | NVA | 0.8857 |
168 | ASN | 0.8854 |
169 | HGY | 0.8852 |
170 | 1GP | 0.8835 |
171 | 3SS | 0.8833 |
172 | FAH | 0.8829 |
173 | DAL | 0.8828 |
174 | R3W | 0.8827 |
175 | CEJ | 0.8825 |
176 | DZZ | 0.8824 |
177 | MZ0 | 0.8822 |
178 | BAQ | 0.8821 |
179 | F3V | 0.8814 |
180 | DAB | 0.8813 |
181 | A2Q | 0.8809 |
182 | GLY | 0.8809 |
183 | DAS | 0.8795 |
184 | CYH | 0.8793 |
185 | HAI | 0.8786 |
186 | AMC | 0.8785 |
187 | 2HA | 0.8779 |
188 | IPH | 0.8777 |
189 | ORN | 0.8773 |
190 | CIZ | 0.8773 |
191 | ATQ | 0.8773 |
192 | CSS | 0.8772 |
193 | AC5 | 0.8771 |
194 | NVI | 0.8770 |
195 | UY7 | 0.8765 |
196 | 273 | 0.8764 |
197 | MLT | 0.8760 |
198 | 23W | 0.8752 |
199 | V1L | 0.8751 |
200 | LMR | 0.8749 |
201 | PIS | 0.8743 |
202 | THE | 0.8740 |
203 | TNE | 0.8739 |
204 | 7EX | 0.8736 |
205 | JBN | 0.8735 |
206 | 2IM | 0.8732 |
207 | GLV | 0.8732 |
208 | MEU | 0.8731 |
209 | LEU | 0.8730 |
210 | 1CB | 0.8725 |
211 | 1DQ | 0.8720 |
212 | ECE | 0.8720 |
213 | TZZ | 0.8716 |
214 | PAF | 0.8708 |
215 | AKR | 0.8703 |
216 | PXO | 0.8703 |
217 | BVG | 0.8702 |
218 | BUO | 0.8688 |
219 | GOA | 0.8685 |
220 | HZP | 0.8682 |
221 | 1BP | 0.8678 |
222 | BVC | 0.8677 |
223 | OAA | 0.8675 |
224 | MET | 0.8673 |
225 | HVQ | 0.8669 |
226 | 23B | 0.8669 |
227 | NIS | 0.8656 |
228 | BXA | 0.8655 |
229 | 1DU | 0.8651 |
230 | IQ0 | 0.8648 |
231 | 2A1 | 0.8645 |
232 | B24 | 0.8641 |
233 | MAK | 0.8639 |
234 | SYN | 0.8636 |
235 | APY | 0.8629 |
236 | L60 | 0.8628 |
237 | PTO | 0.8625 |
238 | 6SP | 0.8622 |
239 | PYM | 0.8622 |
240 | PYC | 0.8622 |
241 | 9A4 | 0.8620 |
242 | HSM | 0.8617 |
243 | 9X6 | 0.8607 |
244 | SRT | 0.8602 |
245 | TF4 | 0.8598 |
246 | CP2 | 0.8591 |
247 | LDU | 0.8590 |
248 | FOA | 0.8588 |
249 | NMU | 0.8572 |
250 | DPF | 0.8563 |
251 | R1X | 0.8561 |
252 | 3ZQ | 0.8556 |
253 | TLA | 0.8554 |
254 | 3ZS | 0.8532 |
This union binding pocket(no: 1) in the query (biounit: 5dvp.bio2) has 5 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 5dvp.bio1) has 6 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |