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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 197 families. | |||||
1 | 3P7I | Kd = 19.9 nM | P7I | C2 H8 N O3 P | C(CP(=O)(O.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 165 families. | |||||
1 | 3P7I | Kd = 19.9 nM | P7I | C2 H8 N O3 P | C(CP(=O)(O.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | TAU | 1.0000 |
2 | COM | 1.0000 |
3 | 8X3 | 1.0000 |
4 | CHT | 1.0000 |
5 | POA | 0.9972 |
6 | XPO | 0.9942 |
7 | VX | 0.9941 |
8 | ETM | 0.9931 |
9 | EFS | 0.9912 |
10 | 9SB | 0.9871 |
11 | FJO | 0.9831 |
12 | BTL | 0.9830 |
13 | A20 | 0.9672 |
14 | PGA | 0.9623 |
15 | S0H | 0.9587 |
16 | FCN | 0.9565 |
17 | OPE | 0.9546 |
18 | PAE | 0.9539 |
19 | 1Y8 | 0.9531 |
20 | TB6 | 0.9522 |
21 | CP | 0.9518 |
22 | HSW | 0.9500 |
23 | MLI | 0.9500 |
24 | 7VD | 0.9484 |
25 | MPD | 0.9483 |
26 | SAT | 0.9471 |
27 | TB0 | 0.9466 |
28 | ODV | 0.9454 |
29 | BAE | 0.9447 |
30 | PCT | 0.9427 |
31 | PPF | 0.9424 |
32 | MMQ | 0.9415 |
33 | TAY | 0.9409 |
34 | 1SP | 0.9405 |
35 | MLA | 0.9376 |
36 | VSO | 0.9373 |
37 | ETF | 0.9358 |
38 | HV2 | 0.9337 |
39 | FW5 | 0.9333 |
40 | BU4 | 0.9315 |
41 | DSS | 0.9307 |
42 | SGL | 0.9287 |
43 | 1AC | 0.9272 |
44 | 8FH | 0.9249 |
45 | IVA | 0.9245 |
46 | CNH | 0.9216 |
47 | BAL | 0.9216 |
48 | KIV | 0.9215 |
49 | 3HL | 0.9209 |
50 | TAN | 0.9189 |
51 | BUA | 0.9189 |
52 | 3HR | 0.9180 |
53 | VAL | 0.9180 |
54 | THR | 0.9179 |
55 | BMD | 0.9179 |
56 | CYS | 0.9178 |
57 | BUB | 0.9177 |
58 | DTL | 0.9168 |
59 | HLT | 0.9142 |
60 | 39J | 0.9142 |
61 | AOA | 0.9138 |
62 | DMG | 0.9118 |
63 | SAR | 0.9113 |
64 | LER | 0.9113 |
65 | ICN | 0.9112 |
66 | 3OH | 0.9111 |
67 | SSN | 0.9109 |
68 | SLP | 0.9101 |
69 | MTG | 0.9100 |
70 | 192 | 0.9090 |
71 | AKB | 0.9083 |
72 | PRO | 0.9078 |
73 | BUQ | 0.9075 |
74 | HBR | 0.9075 |
75 | PAH | 0.9070 |
76 | 03W | 0.9063 |
77 | ITU | 0.9051 |
78 | P2D | 0.9048 |
79 | SER | 0.9047 |
80 | NVA | 0.9046 |
81 | GG6 | 0.9043 |
82 | AAE | 0.9027 |
83 | MLM | 0.9021 |
84 | MRY | 0.9016 |
85 | MSF | 0.9016 |
86 | DXX | 0.9015 |
87 | SIN | 0.9006 |
88 | ALO | 0.9003 |
89 | TFS | 0.9001 |
90 | PUT | 0.9000 |
91 | MAE | 0.9000 |
92 | ABA | 0.8998 |
93 | TFB | 0.8994 |
94 | 2KT | 0.8991 |
95 | 3BB | 0.8989 |
96 | ETX | 0.8988 |
97 | DSN | 0.8979 |
98 | PYR | 0.8979 |
99 | KG7 | 0.8976 |
100 | ALQ | 0.8965 |
101 | 3PY | 0.8964 |
102 | IPU | 0.8951 |
103 | 2OP | 0.8947 |
104 | 1GP | 0.8943 |
105 | OXL | 0.8941 |
106 | HSE | 0.8940 |
107 | ASP | 0.8934 |
108 | 3PP | 0.8931 |
109 | HDA | 0.8930 |
110 | 4HA | 0.8927 |
111 | XAP | 0.8926 |
112 | PPV | 0.8921 |
113 | BXO | 0.8921 |
114 | DE2 | 0.8919 |
115 | C5J | 0.8919 |
116 | PE9 | 0.8918 |
117 | ABU | 0.8916 |
118 | SMB | 0.8915 |
119 | LAC | 0.8915 |
120 | X1S | 0.8907 |
121 | OXM | 0.8902 |
122 | OXD | 0.8900 |
123 | DAL | 0.8895 |
124 | A8C | 0.8892 |
125 | POP | 0.8890 |
126 | DCL | 0.8887 |
127 | DAB | 0.8885 |
128 | EGD | 0.8880 |
129 | HUI | 0.8880 |
130 | 2RA | 0.8877 |
131 | 4MV | 0.8875 |
132 | HIU | 0.8872 |
133 | ASN | 0.8863 |
134 | G3P | 0.8862 |
135 | 3GR | 0.8860 |
136 | 1BP | 0.8857 |
137 | LEA | 0.8857 |
138 | NVI | 0.8853 |
139 | MDN | 0.8847 |
140 | MTD | 0.8843 |
141 | GLY | 0.8841 |
142 | PRS | 0.8841 |
143 | 2PN | 0.8841 |
144 | ALA | 0.8836 |
145 | GOL | 0.8833 |
146 | IHG | 0.8829 |
147 | DGY | 0.8827 |
148 | DZZ | 0.8825 |
149 | AML | 0.8825 |
150 | PIS | 0.8823 |
151 | NCM | 0.8822 |
152 | FLA | 0.8820 |
153 | NMG | 0.8812 |
154 | A3B | 0.8808 |
155 | MZ0 | 0.8808 |
156 | CIZ | 0.8806 |
157 | HCS | 0.8805 |
158 | R3W | 0.8804 |
159 | PRI | 0.8803 |
160 | DBB | 0.8801 |
161 | PPI | 0.8797 |
162 | NAK | 0.8796 |
163 | HVQ | 0.8795 |
164 | FMS | 0.8793 |
165 | C2N | 0.8791 |
166 | 9YL | 0.8790 |
167 | FAH | 0.8786 |
168 | 3SS | 0.8781 |
169 | 2PC | 0.8781 |
170 | DCY | 0.8780 |
171 | PAF | 0.8775 |
172 | F3V | 0.8772 |
173 | HBS | 0.8761 |
174 | AHR | 0.8745 |
175 | 3SY | 0.8743 |
176 | FUM | 0.8743 |
177 | BVG | 0.8741 |
178 | LMR | 0.8736 |
179 | LEU | 0.8733 |
180 | GOA | 0.8731 |
181 | THE | 0.8724 |
182 | ILE | 0.8709 |
183 | NIE | 0.8705 |
184 | 1DQ | 0.8702 |
185 | T2C | 0.8702 |
186 | HZP | 0.8697 |
187 | BXA | 0.8691 |
188 | MEU | 0.8686 |
189 | DPF | 0.8678 |
190 | DAS | 0.8672 |
191 | AC5 | 0.8670 |
192 | 23W | 0.8670 |
193 | AKR | 0.8668 |
194 | HX2 | 0.8663 |
195 | CSS | 0.8658 |
196 | BVC | 0.8656 |
197 | TF4 | 0.8640 |
198 | TZZ | 0.8635 |
199 | BUO | 0.8630 |
200 | 4JU | 0.8622 |
201 | J3K | 0.8613 |
202 | 2HA | 0.8609 |
203 | 3CL | 0.8607 |
204 | CP2 | 0.8606 |
205 | MLT | 0.8602 |
206 | 1SH | 0.8601 |
207 | 2MH | 0.8594 |
208 | 2A3 | 0.8589 |
209 | 1DU | 0.8579 |
210 | PYM | 0.8576 |
211 | 2EZ | 0.8557 |
212 | ORN | 0.8556 |
213 | NMU | 0.8553 |
214 | AMC | 0.8540 |
215 | DMV | 0.8537 |
216 | 9X6 | 0.8532 |
217 | HSM | 0.8511 |
This union binding pocket(no: 1) in the query (biounit: 3p7i.bio1) has 14 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 5LV1 | 78T | 30.3571 |
2 | 5LV1 | 78T | 30.3571 |
This union binding pocket(no: 2) in the query (biounit: 3p7i.bio1) has 14 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |