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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 | 3VV5 | - | SLZ | C5 H12 N2 O2 S | C(CSC[C@@H.... |
2 | 3VVE | - | LYS | C6 H15 N2 O2 | C(CC[NH3+].... |
3 | 3VVF | - | ARG | C6 H15 N4 O2 | C(C[C@@H](.... |
4 | 3VVD | - | ORN | C5 H12 N2 O2 | C(C[C@@H](.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 165 families. | |||||
1 | 3VV5 | - | SLZ | C5 H12 N2 O2 S | C(CSC[C@@H.... |
2 | 3VVE | - | LYS | C6 H15 N2 O2 | C(CC[NH3+].... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | LYN | 0.9823 |
2 | LYS | 0.9791 |
3 | MLZ | 0.9619 |
4 | DLY | 0.9564 |
5 | AG2 | 0.9546 |
6 | MET | 0.9527 |
7 | ORN | 0.9515 |
8 | 3OL | 0.9467 |
9 | NWH | 0.9438 |
10 | HOC | 0.9432 |
11 | GLU | 0.9432 |
12 | 9ON | 0.9425 |
13 | ONH | 0.9413 |
14 | N6C | 0.9384 |
15 | UN1 | 0.9365 |
16 | AKG | 0.9363 |
17 | 2FM | 0.9357 |
18 | GLN | 0.9337 |
19 | EXY | 0.9336 |
20 | ARG | 0.9329 |
21 | 8SZ | 0.9311 |
22 | MSE | 0.9301 |
23 | NLE | 0.9289 |
24 | 7OD | 0.9282 |
25 | 0L1 | 0.9279 |
26 | 6HN | 0.9277 |
27 | OOG | 0.9267 |
28 | DHH | 0.9263 |
29 | HPN | 0.9260 |
30 | NNH | 0.9251 |
31 | OCA | 0.9246 |
32 | 3OM | 0.9245 |
33 | KQY | 0.9242 |
34 | 7C3 | 0.9239 |
35 | 2HG | 0.9202 |
36 | ONL | 0.9188 |
37 | KMT | 0.9180 |
38 | I38 | 0.9178 |
39 | PBA | 0.9177 |
40 | GGL | 0.9170 |
41 | MLY | 0.9164 |
42 | O45 | 0.9163 |
43 | IAR | 0.9153 |
44 | DAR | 0.9153 |
45 | MHO | 0.9149 |
46 | S8V | 0.9147 |
47 | OC9 | 0.9142 |
48 | CUW | 0.9142 |
49 | AE3 | 0.9125 |
50 | DIR | 0.9109 |
51 | NPI | 0.9106 |
52 | CIR | 0.9106 |
53 | TEG | 0.9099 |
54 | SHV | 0.9093 |
55 | MED | 0.9092 |
56 | MHN | 0.9078 |
57 | LT1 | 0.9068 |
58 | 2IT | 0.9066 |
59 | PRA | 0.9063 |
60 | 3H2 | 0.9062 |
61 | MPH | 0.9057 |
62 | S2G | 0.9057 |
63 | ILO | 0.9051 |
64 | ACA | 0.9038 |
65 | 5XA | 0.9032 |
66 | 9YT | 0.9025 |
67 | 258 | 0.9022 |
68 | ODI | 0.9020 |
69 | PML | 0.9005 |
70 | NMH | 0.8999 |
71 | GGB | 0.8997 |
72 | MEQ | 0.8981 |
73 | GVA | 0.8977 |
74 | KNA | 0.8977 |
75 | DIA | 0.8967 |
76 | MPJ | 0.8958 |
77 | N8C | 0.8957 |
78 | SSB | 0.8953 |
79 | KPA | 0.8951 |
80 | 268 | 0.8950 |
81 | KDG | 0.8946 |
82 | BHH | 0.8944 |
83 | FXY | 0.8941 |
84 | NLP | 0.8939 |
85 | GRQ | 0.8929 |
86 | OYA | 0.8925 |
87 | HGA | 0.8905 |
88 | B3M | 0.8901 |
89 | N4B | 0.8895 |
90 | 11C | 0.8891 |
91 | HE4 | 0.8888 |
92 | 650 | 0.8888 |
93 | SPD | 0.8886 |
94 | DKA | 0.8886 |
95 | AHN | 0.8878 |
96 | AHL | 0.8872 |
97 | YPN | 0.8861 |
98 | D10 | 0.8860 |
99 | OCT | 0.8860 |
100 | ABH | 0.8854 |
101 | MF3 | 0.8853 |
102 | NTU | 0.8852 |
103 | HL4 | 0.8837 |
104 | OHJ | 0.8831 |
105 | HL5 | 0.8830 |
106 | PBN | 0.8825 |
107 | 5OY | 0.8824 |
108 | ENV | 0.8822 |
109 | NOT | 0.8820 |
110 | 7BC | 0.8812 |
111 | 7XA | 0.8792 |
112 | HAR | 0.8759 |
113 | PG0 | 0.8746 |
114 | CLT | 0.8725 |
115 | FB6 | 0.8700 |
116 | BHL | 0.8698 |
117 | M3L | 0.8696 |
118 | 49F | 0.8681 |
119 | SKJ | 0.8670 |
120 | Z70 | 0.8666 |
121 | 7UC | 0.8656 |
122 | 8GL | 0.8649 |
123 | MD0 | 0.8645 |
124 | 1HS | 0.8645 |
125 | S2C | 0.8637 |
126 | 263 | 0.8636 |
127 | HTX | 0.8615 |
128 | ENW | 0.8612 |
129 | 2NP | 0.8605 |
130 | Q06 | 0.8602 |
131 | 16D | 0.8598 |
132 | 4TB | 0.8584 |
133 | 2EH | 0.8580 |
134 | 26P | 0.8571 |
135 | 3YP | 0.8559 |
136 | 3GZ | 0.8540 |
137 | FOM | 0.8530 |