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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
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- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 2 families. | |||||
1 | 1YOE | - | RIB | C5 H10 O5 | C([C@@H]1[.... |
2 | 3G5I | - | DNB | C11 H17 N3 O3 | c1cc(c(cc1.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 2MAS | Kd = 30 nM | PIR | C11 H16 N2 O3 | c1cc(ccc1[.... |
2 | 1YOE | - | RIB | C5 H10 O5 | C([C@@H]1[.... |
3 | 3G5I | - | DNB | C11 H17 N3 O3 | c1cc(c(cc1.... |
4 | 3MKN | Ki = 76 uM | DNB | C11 H17 N3 O3 | c1cc(c(cc1.... |
5 | 3B9X | - | NOS | C10 H12 N4 O5 | c1nc2c(n1[.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | ADN | 0.9602 |
2 | NOS | 0.9562 |
3 | TBN | 0.9512 |
4 | FMC | 0.9450 |
5 | FM1 | 0.9432 |
6 | CTN | 0.9413 |
7 | MTA | 0.9403 |
8 | FMB | 0.9401 |
9 | THM | 0.9379 |
10 | TAL | 0.9378 |
11 | 0DN | 0.9375 |
12 | PUR | 0.9372 |
13 | ZEB | 0.9361 |
14 | URI | 0.9356 |
15 | 2TU | 0.9346 |
16 | DHZ | 0.9321 |
17 | 5UD | 0.9320 |
18 | MCY | 0.9295 |
19 | DCZ | 0.9290 |
20 | FM2 | 0.9260 |
21 | TYU | 0.9248 |
22 | IMH | 0.9242 |
23 | B86 | 0.9241 |
24 | ID2 | 0.9237 |
25 | MDR | 0.9235 |
26 | 2FA | 0.9234 |
27 | DUR | 0.9226 |
28 | GMP | 0.9220 |
29 | 49O | 0.9201 |
30 | XYA | 0.9201 |
31 | 5BT | 0.9199 |
32 | MTP | 0.9180 |
33 | URD | 0.9180 |
34 | CTD | 0.9163 |
35 | W29 | 0.9152 |
36 | JRB | 0.9146 |
37 | THU | 0.9145 |
38 | RBV | 0.9133 |
39 | B2Y | 0.9128 |
40 | 61O | 0.9127 |
41 | A | 0.9123 |
42 | ANU | 0.9118 |
43 | K80 | 0.9116 |
44 | GTC | 0.9106 |
45 | 5VL | 0.9104 |
46 | 6CR | 0.9090 |
47 | BRD | 0.9087 |
48 | MPK | 0.9083 |
49 | SV4 | 0.9081 |
50 | CH9 | 0.9078 |
51 | 5AD | 0.9073 |
52 | 1DA | 0.9072 |
53 | PQT | 0.9050 |
54 | PJW | 0.9047 |
55 | MTM | 0.9042 |
56 | I5A | 0.9037 |
57 | GEO | 0.9037 |
58 | 3D1 | 0.9035 |
59 | MOK | 0.9031 |
60 | PRH | 0.9028 |
61 | 6HX | 0.9026 |
62 | HNK | 0.9014 |
63 | BP3 | 0.9013 |
64 | 5NB | 0.9010 |
65 | HJH | 0.9009 |
66 | 2FD | 0.9007 |
67 | 9UL | 0.8999 |
68 | RAB | 0.8997 |
69 | HPR | 0.8992 |
70 | SLY | 0.8985 |
71 | 1WC | 0.8981 |
72 | 9W5 | 0.8977 |
73 | 4WF | 0.8973 |
74 | 5E4 | 0.8967 |
75 | BDJ | 0.8966 |
76 | RIS | 0.8966 |
77 | NNR | 0.8958 |
78 | N8Z | 0.8952 |
79 | OBP | 0.8949 |
80 | WOE | 0.8948 |
81 | 5AE | 0.8947 |
82 | ID8 | 0.8942 |
83 | C0H | 0.8942 |
84 | BPY | 0.8941 |
85 | 3DT | 0.8941 |
86 | CH8 | 0.8936 |
87 | MTH | 0.8935 |
88 | FPL | 0.8932 |
89 | AD3 | 0.8930 |
90 | XDK | 0.8926 |
91 | ING | 0.8925 |
92 | RLG | 0.8920 |
93 | F16 | 0.8918 |
94 | 2B4 | 0.8918 |
95 | DBM | 0.8916 |
96 | U2Z | 0.8916 |
97 | DE3 | 0.8915 |
98 | SQP | 0.8907 |
99 | A1Y | 0.8906 |
100 | BPS | 0.8904 |
101 | MJ5 | 0.8893 |
102 | 49N | 0.8890 |
103 | 5JT | 0.8890 |
104 | 9PL | 0.8889 |
105 | 89J | 0.8888 |
106 | NQ7 | 0.8887 |
107 | 7Q1 | 0.8885 |
108 | NI9 | 0.8878 |
109 | B4O | 0.8873 |
110 | BP6 | 0.8869 |
111 | JVQ | 0.8867 |
112 | DAH | 0.8865 |
113 | Y3J | 0.8863 |
114 | 7ZL | 0.8862 |
115 | A3Q | 0.8861 |
116 | A9O | 0.8857 |
117 | GFE | 0.8857 |
118 | A7K | 0.8857 |
119 | MZR | 0.8856 |
120 | YOF | 0.8854 |
121 | 3B4 | 0.8854 |
122 | DC5 | 0.8854 |
123 | L13 | 0.8847 |
124 | 60Q | 0.8847 |
125 | A6H | 0.8845 |
126 | A4D | 0.8844 |
127 | 0OO | 0.8843 |
128 | 977 | 0.8835 |
129 | 9DI | 0.8833 |
130 | DDU | 0.8832 |
131 | 0A9 | 0.8830 |
132 | 458 | 0.8828 |
133 | T2D | 0.8827 |
134 | AVI | 0.8827 |
135 | A4Q | 0.8824 |
136 | CP6 | 0.8823 |
137 | BTM | 0.8821 |
138 | GL2 | 0.8821 |
139 | X11 | 0.8819 |
140 | 5N5 | 0.8818 |
141 | NIR | 0.8815 |
142 | CMU | 0.8814 |
143 | QUS | 0.8813 |
144 | CWD | 0.8812 |
145 | A4T | 0.8809 |
146 | A9K | 0.8802 |
147 | ZOL | 0.8799 |
148 | FWD | 0.8799 |
149 | 46P | 0.8798 |
150 | GL7 | 0.8781 |
151 | 3QO | 0.8779 |
152 | 6J9 | 0.8779 |
153 | 1Z8 | 0.8776 |
154 | BZQ | 0.8775 |
155 | EXG | 0.8775 |
156 | TH4 | 0.8775 |
157 | EAJ | 0.8772 |
158 | 3AD | 0.8772 |
159 | KYN | 0.8771 |
160 | MIL | 0.8770 |
161 | A4N | 0.8766 |
162 | 6HO | 0.8766 |
163 | CLU | 0.8765 |
164 | B2T | 0.8761 |
165 | TRP | 0.8760 |
166 | 16Z | 0.8756 |
167 | 1ZC | 0.8755 |
168 | AKD | 0.8752 |
169 | 7QS | 0.8752 |
170 | ACE PHE | 0.8749 |
171 | 5CD | 0.8745 |
172 | 5FD | 0.8744 |
173 | CC5 | 0.8743 |
174 | TIZ | 0.8740 |
175 | HNH | 0.8738 |
176 | IM4 | 0.8736 |
177 | BCK | 0.8735 |
178 | TCL | 0.8735 |
179 | 54F | 0.8732 |
180 | S0G | 0.8726 |
181 | 7VY | 0.8723 |
182 | GLS | 0.8720 |
183 | RFZ | 0.8717 |
184 | AVJ | 0.8712 |
185 | N1Y | 0.8712 |
186 | S3C | 0.8712 |
187 | HFA | 0.8709 |
188 | CK2 | 0.8708 |
189 | BWD | 0.8707 |
190 | 78U | 0.8703 |
191 | 50Q | 0.8703 |
192 | C2M | 0.8702 |
193 | AWE | 0.8700 |
194 | 1A7 | 0.8694 |
195 | 50C | 0.8693 |
196 | FNA | 0.8693 |
197 | CK1 | 0.8691 |
198 | A9P | 0.8689 |
199 | ZIQ | 0.8687 |
200 | XFE | 0.8686 |
201 | 1VK | 0.8685 |
202 | 2LT | 0.8684 |
203 | HNL | 0.8682 |
204 | 4UO | 0.8681 |
205 | 1XA | 0.8680 |
206 | GL5 | 0.8679 |
207 | F5F | 0.8677 |
208 | 1CY | 0.8670 |
209 | 5F1 | 0.8667 |
210 | MTI | 0.8665 |
211 | TI7 | 0.8663 |
212 | 54E | 0.8661 |
213 | IYR | 0.8660 |
214 | R9J | 0.8658 |
215 | MXD | 0.8658 |
216 | 4GU | 0.8657 |
217 | LLT | 0.8657 |
218 | GL4 | 0.8654 |
219 | S7V | 0.8654 |
220 | BZS | 0.8654 |
221 | HHV | 0.8653 |
222 | M0N | 0.8651 |
223 | N2Y | 0.8647 |
224 | HO6 | 0.8646 |
225 | M02 | 0.8646 |
226 | TT4 | 0.8643 |
227 | IWD | 0.8643 |
228 | 88R | 0.8643 |
229 | R2P | 0.8642 |
230 | 3RP | 0.8641 |
231 | FUZ | 0.8636 |
232 | AOT | 0.8636 |
233 | PPY | 0.8634 |
234 | PHE | 0.8632 |
235 | A4B | 0.8631 |
236 | AUV | 0.8629 |
237 | NWW | 0.8626 |
238 | 1FF | 0.8625 |
239 | S2P | 0.8623 |
240 | 8OX | 0.8622 |
241 | TYR | 0.8620 |
242 | 7R4 | 0.8618 |
243 | LT8 | 0.8616 |
244 | LTT | 0.8616 |
245 | 42R | 0.8611 |
246 | WVV | 0.8609 |
247 | DIF | 0.8607 |
248 | CL9 | 0.8602 |
249 | JVN | 0.8602 |
250 | ONR | 0.8599 |
251 | P2L | 0.8595 |
252 | DCF | 0.8594 |
253 | JF6 | 0.8592 |
254 | C6J | 0.8590 |
255 | TOH | 0.8588 |
256 | RVD | 0.8584 |
257 | JA3 | 0.8583 |
258 | 3YQ | 0.8573 |
259 | GVG | 0.8572 |
260 | TYC | 0.8568 |
261 | 159 | 0.8567 |
262 | TR7 | 0.8565 |
263 | 1U7 | 0.8563 |
264 | 9PY | 0.8563 |
265 | 6MD | 0.8552 |
266 | N2Z | 0.8549 |
267 | LDC | 0.8547 |
268 | AMQ | 0.8543 |
269 | HWD | 0.8538 |
270 | AMR | 0.8537 |
271 | Y4L | 0.8523 |
272 | XRS | 0.8505 |
This union binding pocket(no: 2) in the query (biounit: 1yoe.bio2) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 1yoe.bio3) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 3EPW | JMQ | 38.1988 |
2 | 3EPW | JMQ | 38.1988 |
This union binding pocket(no: 4) in the query (biounit: 1yoe.bio3) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 5) in the query (biounit: 1yoe.bio1) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 6) in the query (biounit: 1yoe.bio1) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 7) in the query (biounit: 1yoe.bio1) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 8) in the query (biounit: 1yoe.bio1) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 9) in the query (biounit: 1yoe.bio4) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 10) in the query (biounit: 1yoe.bio4) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 11) in the query (biounit: 1yoe.bio4) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 12) in the query (biounit: 1yoe.bio4) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |