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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 2 families. | |||||
1 | 5OL4 | - | 9XN | H4 N O2 P S | NP(=S)(O)O |
2 | 4UBP | Ki = 2.6 uM | HAE | C2 H5 N O2 | CC(=O)NO |
3 | 6H8J | Ki = 0.62 nM | 2PA | H5 N2 O2 P | NP(=O)(N)O |
4 | 4AC7 | - | FLC | C6 H5 O7 | C(C(=O)[O-.... |
5 | 4CEX | - | F | F | [F-] |
6 | 6RKG | - | 2PA | H5 N2 O2 P | NP(=O)(N)O |
7 | 6RP1 | - | 2PA | H5 N2 O2 P | NP(=O)(N)O |
8 | 3UBP | - | 2PA | H5 N2 O2 P | NP(=O)(N)O |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 1FWE | - | HAE | C2 H5 N O2 | CC(=O)NO |
2 | 5OL4 | - | 9XN | H4 N O2 P S | NP(=S)(O)O |
3 | 4UBP | Ki = 2.6 uM | HAE | C2 H5 N O2 | CC(=O)NO |
4 | 6H8J | Ki = 0.62 nM | 2PA | H5 N2 O2 P | NP(=O)(N)O |
5 | 4AC7 | - | FLC | C6 H5 O7 | C(C(=O)[O-.... |
6 | 4CEX | - | F | F | [F-] |
7 | 6RKG | - | 2PA | H5 N2 O2 P | NP(=O)(N)O |
8 | 6RP1 | - | 2PA | H5 N2 O2 P | NP(=O)(N)O |
9 | 3UBP | - | 2PA | H5 N2 O2 P | NP(=O)(N)O |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | NMU | 1.0000 |
2 | ALA | 1.0000 |
3 | F3V | 1.0000 |
4 | 2A3 | 1.0000 |
5 | J3K | 1.0000 |
6 | 2A1 | 1.0000 |
7 | 61G | 1.0000 |
8 | FAH | 1.0000 |
9 | GOA | 1.0000 |
10 | GLY | 1.0000 |
11 | PPI | 1.0000 |
12 | MGX | 1.0000 |
13 | TSZ | 1.0000 |
14 | AGU | 1.0000 |
15 | AKR | 1.0000 |
16 | F50 | 1.0000 |
17 | GLV | 1.0000 |
18 | NIE | 1.0000 |
19 | HVB | 0.9964 |
20 | ATO | 0.9886 |
21 | R3W | 0.9860 |
22 | BRP | 0.9856 |
23 | 1BP | 0.9839 |
24 | CP2 | 0.9835 |
25 | TCV | 0.9819 |
26 | GOL | 0.9776 |
27 | BXA | 0.9746 |
28 | GXV | 0.9711 |
29 | OXL | 0.9691 |
30 | 3GR | 0.9690 |
31 | MEU | 0.9664 |
32 | LAC | 0.9650 |
33 | OXM | 0.9648 |
34 | HGY | 0.9630 |
35 | MMU | 0.9615 |
36 | BU4 | 0.9594 |
37 | 2HA | 0.9592 |
38 | DAL | 0.9592 |
39 | PYR | 0.9589 |
40 | GBL | 0.9587 |
41 | 3MT | 0.9583 |
42 | ACT | 0.9580 |
43 | PXO | 0.9578 |
44 | 1CB | 0.9576 |
45 | OXD | 0.9575 |
46 | NIS | 0.9575 |
47 | 6SP | 0.9570 |
48 | 3OH | 0.9563 |
49 | AOA | 0.9563 |
50 | HBS | 0.9557 |
51 | HBR | 0.9545 |
52 | MZY | 0.9544 |
53 | BAQ | 0.9539 |
54 | CYS | 0.9537 |
55 | 2OP | 0.9528 |
56 | ABA | 0.9524 |
57 | PYM | 0.9515 |
58 | ATQ | 0.9507 |
59 | BUO | 0.9501 |
60 | ACM | 0.9497 |
61 | 3TR | 0.9497 |
62 | AMT | 0.9497 |
63 | HOW | 0.9484 |
64 | ALQ | 0.9481 |
65 | 4MZ | 0.9479 |
66 | 1MZ | 0.9479 |
67 | BUA | 0.9478 |
68 | 2AI | 0.9474 |
69 | 2MZ | 0.9473 |
70 | SEY | 0.9471 |
71 | MR3 | 0.9468 |
72 | AXO | 0.9468 |
73 | 5Y9 | 0.9462 |
74 | NAK | 0.9459 |
75 | 5MP | 0.9456 |
76 | CRD | 0.9448 |
77 | SAR | 0.9445 |
78 | 5KX | 0.9442 |
79 | JZ6 | 0.9433 |
80 | BAL | 0.9427 |
81 | AF3 | 0.9415 |
82 | 9A4 | 0.9414 |
83 | EGD | 0.9413 |
84 | BMD | 0.9407 |
85 | ETF | 0.9392 |
86 | D2P | 0.9392 |
87 | BEF | 0.9389 |
88 | 3ZS | 0.9385 |
89 | BYZ | 0.9369 |
90 | EDO | 0.9366 |
91 | 13D | 0.9362 |
92 | TRI | 0.9359 |
93 | IPA | 0.9356 |
94 | 3CL | 0.9346 |
95 | PZO | 0.9342 |
96 | ALF | 0.9341 |
97 | 2PO | 0.9341 |
98 | 78T | 0.9341 |
99 | ES3 | 0.9339 |
100 | IMD | 0.9327 |
101 | HUH | 0.9320 |
102 | NOE | 0.9310 |
103 | OSM | 0.9294 |
104 | VSO | 0.9289 |
105 | PYZ | 0.9289 |
106 | 3BB | 0.9271 |
107 | KCS | 0.9264 |
108 | TF4 | 0.9260 |
109 | 9A7 | 0.9253 |
110 | 2KT | 0.9247 |
111 | BRJ | 0.9244 |
112 | XAP | 0.9230 |
113 | XIX | 0.9222 |
114 | HYN | 0.9212 |
115 | HSW | 0.9208 |
116 | FW5 | 0.9200 |
117 | BBU | 0.9183 |
118 | TAN | 0.9182 |
119 | THR | 0.9178 |
120 | MTG | 0.9167 |
121 | MB3 | 0.9162 |
122 | SER | 0.9155 |
123 | SLP | 0.9155 |
124 | 25T | 0.9148 |
125 | 24T | 0.9147 |
126 | 03W | 0.9141 |
127 | DGY | 0.9141 |
128 | 8FH | 0.9138 |
129 | DSN | 0.9135 |
130 | DE2 | 0.9133 |
131 | HIU | 0.9130 |
132 | DCE | 0.9129 |
133 | HUI | 0.9125 |
134 | 3PY | 0.9123 |
135 | 2RA | 0.9120 |
136 | CNH | 0.9113 |
137 | DXX | 0.9107 |
138 | P1R | 0.9107 |
139 | SMB | 0.9107 |
140 | DBB | 0.9105 |
141 | A3B | 0.9105 |
142 | KG7 | 0.9105 |
143 | A2Q | 0.9097 |
144 | 0PY | 0.9095 |
145 | B20 | 0.9092 |
146 | BUB | 0.9092 |
147 | CEJ | 0.9088 |
148 | TB0 | 0.9081 |
149 | MMZ | 0.9076 |
150 | BNZ | 0.9068 |
151 | E60 | 0.9064 |
152 | QPT | 0.9061 |
153 | MZ0 | 0.9053 |
154 | 1AC | 0.9052 |
155 | CYH | 0.9052 |
156 | CXL | 0.9052 |
157 | 3BR | 0.9044 |
158 | HAI | 0.9040 |
159 | 4AX | 0.9036 |
160 | 1DH | 0.9027 |
161 | 7EX | 0.9022 |
162 | BXO | 0.9020 |
163 | 0CL | 0.9018 |
164 | HSL | 0.9017 |
165 | PHZ | 0.9009 |
166 | KSW | 0.9001 |
167 | L60 | 0.8989 |
168 | 39J | 0.8987 |
169 | MBN | 0.8986 |
170 | DTI | 0.8985 |
171 | V1L | 0.8983 |
172 | 9PO | 0.8982 |
173 | DMI | 0.8979 |
174 | MMQ | 0.8976 |
175 | LGA | 0.8970 |
176 | 2IM | 0.8969 |
177 | HVK | 0.8967 |
178 | MCH | 0.8965 |
179 | 2AP | 0.8965 |
180 | 3AP | 0.8965 |
181 | 93B | 0.8962 |
182 | 4AP | 0.8960 |
183 | HRZ | 0.8958 |
184 | CHT | 0.8957 |
185 | VN4 | 0.8956 |
186 | ETX | 0.8954 |
187 | C2N | 0.8950 |
188 | MSF | 0.8950 |
189 | IPH | 0.8932 |
190 | PRI | 0.8929 |
191 | WOT | 0.8924 |
192 | DCY | 0.8923 |
193 | NVI | 0.8919 |
194 | GXE | 0.8916 |
195 | MLI | 0.8915 |
196 | 1SP | 0.8914 |
197 | DMG | 0.8910 |
198 | PUT | 0.8905 |
199 | TMO | 0.8895 |
200 | PIH | 0.8892 |
201 | ITU | 0.8891 |
202 | 8CL | 0.8886 |
203 | BVG | 0.8880 |
204 | BVC | 0.8866 |
205 | HVQ | 0.8866 |
206 | 2EZ | 0.8852 |
207 | FPO | 0.8845 |
208 | HV2 | 0.8841 |
209 | HHN | 0.8839 |
210 | 03S | 0.8836 |
211 | CB0 | 0.8824 |
212 | FJO | 0.8823 |
213 | C5J | 0.8823 |
214 | ETM | 0.8821 |
215 | TTO | 0.8813 |
216 | MTD | 0.8809 |
217 | 2HP | 0.8801 |
218 | TBU | 0.8790 |
219 | XPO | 0.8788 |
220 | MLA | 0.8772 |
221 | HGW | 0.8770 |
222 | TAY | 0.8753 |
223 | DSS | 0.8752 |
224 | 8X3 | 0.8750 |
225 | PPF | 0.8749 |
226 | TAU | 0.8749 |
227 | PO4 | 0.8746 |
228 | 2HE | 0.8727 |
229 | BF4 | 0.8713 |
230 | HLT | 0.8706 |
231 | GB | 0.8702 |
232 | 2PA | 0.8676 |
233 | 3HL | 0.8672 |
234 | 3HR | 0.8672 |
235 | P2D | 0.8665 |
236 | 73M | 0.8625 |
237 | FUS | 0.8594 |
This union binding pocket(no: 1) in the query (biounit: 6h8j.bio1) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 6h8j.bio1) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 6h8j.bio1) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |