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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 277 families. | |||||
1 | 2J8R | - | MSL | C5 H12 N2 O3 S | C[S@](=N)(.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 212 families. | |||||
1 | 2J8R | - | MSL | C5 H12 N2 O3 S | C[S@](=N)(.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | SEP | 0.9834 |
2 | 3PG | 0.9693 |
3 | HPV | 0.9652 |
4 | CYX | 0.9562 |
5 | AKG | 0.9533 |
6 | 13P | 0.9525 |
7 | AT3 | 0.9509 |
8 | S2G | 0.9500 |
9 | GLU | 0.9492 |
10 | CHH | 0.9488 |
11 | GLN | 0.9472 |
12 | PGH | 0.9468 |
13 | OGA | 0.9458 |
14 | GPJ | 0.9439 |
15 | GPF | 0.9439 |
16 | 7OD | 0.9415 |
17 | PSE | 0.9400 |
18 | 2HG | 0.9393 |
19 | E4P | 0.9383 |
20 | NM3 | 0.9381 |
21 | NM2 | 0.9381 |
22 | LTL | 0.9361 |
23 | IP8 | 0.9352 |
24 | 9ON | 0.9347 |
25 | ONL | 0.9325 |
26 | 2IT | 0.9313 |
27 | HG3 | 0.9302 |
28 | CCE | 0.9299 |
29 | LUQ | 0.9273 |
30 | MHO | 0.9273 |
31 | CCD | 0.9265 |
32 | 4LR | 0.9256 |
33 | FOM | 0.9253 |
34 | GP9 | 0.9233 |
35 | 152 | 0.9229 |
36 | G3H | 0.9191 |
37 | LYN | 0.9188 |
38 | MET | 0.9187 |
39 | G3P | 0.9179 |
40 | RTK | 0.9172 |
41 | NSB | 0.9158 |
42 | ORN | 0.9151 |
43 | QMP | 0.9147 |
44 | NLE | 0.9145 |
45 | HGA | 0.9145 |
46 | 11C | 0.9141 |
47 | DGN | 0.9141 |
48 | DHM | 0.9140 |
49 | 1GP | 0.9116 |
50 | GUA | 0.9104 |
51 | LYS | 0.9104 |
52 | GVM | 0.9101 |
53 | MZT | 0.9093 |
54 | 2FM | 0.9084 |
55 | DGL | 0.9079 |
56 | 9GB | 0.9076 |
57 | 1X4 | 0.9075 |
58 | UN1 | 0.9064 |
59 | KDG | 0.9060 |
60 | EOU | 0.9060 |
61 | 7C3 | 0.9051 |
62 | 9YT | 0.9049 |
63 | 3LR | 0.9042 |
64 | DZA | 0.9039 |
65 | ONH | 0.9039 |
66 | O45 | 0.9038 |
67 | 0VT | 0.9027 |
68 | DIR | 0.9022 |
69 | S8V | 0.9021 |
70 | HSX | 0.9017 |
71 | 3YP | 0.9011 |
72 | DER | 0.9010 |
73 | LX1 | 0.9006 |
74 | PC | 0.9005 |
75 | 5RP | 0.9001 |
76 | OOG | 0.8999 |
77 | 650 | 0.8990 |
78 | MF3 | 0.8983 |
79 | 2JJ | 0.8977 |
80 | 4TP | 0.8972 |
81 | DEZ | 0.8969 |
82 | PO6 | 0.8966 |
83 | 0L1 | 0.8952 |
84 | 5DL | 0.8952 |
85 | TIH | 0.8946 |
86 | DHI | 0.8943 |
87 | AMS | 0.8941 |
88 | TEG | 0.8938 |
89 | DXP | 0.8933 |
90 | MAJ | 0.8903 |
91 | DAL DAL | 0.8894 |
92 | EVF | 0.8889 |
93 | MPJ | 0.8886 |
94 | X1S | 0.8886 |
95 | 5XB | 0.8876 |
96 | OEG | 0.8871 |
97 | MSE | 0.8871 |
98 | HIS | 0.8864 |
99 | HPS | 0.8863 |
100 | SYC | 0.8858 |
101 | ACA | 0.8849 |
102 | MEQ | 0.8837 |
103 | HHI | 0.8827 |
104 | BL0 | 0.8825 |
105 | ALA ALA | 0.8824 |
106 | AG2 | 0.8822 |
107 | N9J | 0.8822 |
108 | 36E | 0.8820 |
109 | SHV | 0.8816 |
110 | RP5 | 0.8815 |
111 | HC4 | 0.8810 |
112 | AZM | 0.8808 |
113 | 7BC | 0.8802 |
114 | URO | 0.8792 |
115 | J9N | 0.8791 |
116 | ARG | 0.8780 |
117 | BNF | 0.8773 |
118 | ILO | 0.8766 |
119 | 49F | 0.8762 |
120 | 268 | 0.8757 |
121 | ENV | 0.8755 |
122 | PPY | 0.8755 |
123 | AHN | 0.8754 |
124 | KVV | 0.8754 |
125 | S7A | 0.8750 |
126 | LFC | 0.8749 |
127 | 3HG | 0.8748 |
128 | PGA | 0.8745 |
129 | Q06 | 0.8727 |
130 | SNU | 0.8727 |
131 | 3OM | 0.8721 |
132 | PMF | 0.8720 |
133 | MLZ | 0.8710 |
134 | 2O6 | 0.8710 |
135 | NLP | 0.8709 |
136 | 2BX | 0.8707 |
137 | NNH | 0.8706 |
138 | CCU | 0.8702 |
139 | A5E | 0.8700 |
140 | BNL | 0.8689 |
141 | B40 | 0.8674 |
142 | KMH | 0.8671 |
143 | PBA | 0.8669 |
144 | PHU | 0.8664 |
145 | CPZ | 0.8663 |
146 | R2P | 0.8661 |
147 | JAW | 0.8657 |
148 | F06 | 0.8656 |
149 | DPN | 0.8652 |
150 | MPH | 0.8652 |
151 | ESX | 0.8643 |
152 | F4E | 0.8641 |
153 | 5SP | 0.8633 |
154 | GZ3 | 0.8632 |
155 | NYL | 0.8631 |
156 | 4LW | 0.8623 |
157 | 1L5 | 0.8620 |
158 | GCO | 0.8618 |
159 | ESP | 0.8611 |
160 | PHE | 0.8609 |
161 | HX4 | 0.8600 |
162 | NF3 | 0.8596 |
163 | LLH | 0.8595 |
164 | 1SA | 0.8591 |
165 | A5P | 0.8586 |
166 | 36Y | 0.8585 |
167 | 6NT | 0.8584 |
168 | 4NP | 0.8564 |
169 | JDN | 0.8548 |
170 | IWT | 0.8539 |
171 | NCT | 0.8538 |
172 | 8K2 | 0.8524 |
173 | M4T | 0.8519 |
This union binding pocket(no: 1) in the query (biounit: 2j8r.bio1) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 2j8r.bio1) has 12 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |