- Navigate
- Expand All | Collapse All
- Receptor | Ligand | View in 3D
- Family: 90% | 70% | 50% | site
- External Links
- |
- Download
- 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 21 families. | |||||
1 | 4GVF | - | NAG | C8 H15 N O6 | CC(=O)N[C@.... |
2 | 4GVI | - | NAG AH0 | n/a | n/a |
3 | 4HZM | Ki = 23.2 uM | 1BW | C10 H20 N2 O4 | CCCC(=O)N[.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 16 families. | |||||
1 | 5UTQ | Ki = 0.05 uM | OAN | C15 H19 N3 O7 | CC(=O)N[C@.... |
2 | 5UTP | Ki = 3 uM | 8M7 | C19 H27 N3 O7 | CCC(CC)C(=.... |
3 | 4MSS | Ki = 3.6 uM | 2CZ | C8 H16 N2 O4 | CC(=O)N[C@.... |
4 | 5UTR | Kd = 7 uM | 8MP | C10 H20 N2 O4 | CCCC(=O)N[.... |
5 | 3GSM | - | VPU | C18 H25 N3 O7 | CCCCC(=O)N.... |
6 | 2OXN | Ki = 0.036 uM | OAN | C15 H19 N3 O7 | CC(=O)N[C@.... |
7 | 3GS6 | - | NP6 | C17 H23 N3 O7 | CCCC(=O)N[.... |
8 | 1Y65 | - | NAG | C8 H15 N O6 | CC(=O)N[C@.... |
9 | 4GVF | - | NAG | C8 H15 N O6 | CC(=O)N[C@.... |
10 | 4GVI | - | NAG AH0 | n/a | n/a |
11 | 4HZM | Ki = 23.2 uM | 1BW | C10 H20 N2 O4 | CCCC(=O)N[.... |
12 | 5G3R | - | NAG | C8 H15 N O6 | CC(=O)N[C@.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | BGN | 0.9638 |
2 | VPU | 0.9457 |
3 | STZ | 0.9436 |
4 | YX1 | 0.9436 |
5 | NAG | 0.9316 |
6 | AJG | 0.9282 |
7 | 7EH | 0.9209 |
8 | HBI | 0.9205 |
9 | 1FE | 0.9188 |
10 | B41 | 0.9173 |
11 | Y3L | 0.9171 |
12 | NDG | 0.9161 |
13 | PLP | 0.9149 |
14 | QIV | 0.9148 |
15 | MUR | 0.9145 |
16 | H4B | 0.9141 |
17 | GB4 | 0.9109 |
18 | AZY | 0.9107 |
19 | K82 | 0.9083 |
20 | DAH | 0.9076 |
21 | SJK | 0.9074 |
22 | RSV | 0.9057 |
23 | GDL | 0.9037 |
24 | 4NR | 0.9037 |
25 | CIY | 0.9034 |
26 | FER | 0.9033 |
27 | 4FE | 0.9032 |
28 | PMP | 0.9029 |
29 | CG | 0.9026 |
30 | NB1 | 0.9026 |
31 | KF5 | 0.9020 |
32 | H75 | 0.9013 |
33 | 5OO | 0.9010 |
34 | 2FX | 0.9003 |
35 | ZEA | 0.9003 |
36 | Q0K | 0.9001 |
37 | 0UL | 0.8991 |
38 | 4CN | 0.8982 |
39 | 3SU | 0.8979 |
40 | TRP | 0.8971 |
41 | ZSP | 0.8970 |
42 | GB5 | 0.8969 |
43 | NAL | 0.8969 |
44 | 2JX | 0.8965 |
45 | FMQ | 0.8964 |
46 | 2WU | 0.8964 |
47 | X0T | 0.8963 |
48 | PLR | 0.8961 |
49 | 5VU | 0.8961 |
50 | PIQ | 0.8960 |
51 | N7I | 0.8959 |
52 | GLP | 0.8957 |
53 | 4AF | 0.8957 |
54 | FT6 | 0.8951 |
55 | G6P | 0.8949 |
56 | 0DF | 0.8948 |
57 | S0D | 0.8944 |
58 | PH3 | 0.8942 |
59 | 9NB | 0.8941 |
60 | 109 | 0.8938 |
61 | 27K | 0.8936 |
62 | HMZ | 0.8935 |
63 | 4AB | 0.8935 |
64 | KLV | 0.8935 |
65 | ALX | 0.8932 |
66 | LTM | 0.8930 |
67 | IOP | 0.8925 |
68 | LTT | 0.8925 |
69 | J1K | 0.8924 |
70 | NY4 | 0.8922 |
71 | C4E | 0.8919 |
72 | MMS | 0.8916 |
73 | 54E | 0.8915 |
74 | TYR | 0.8915 |
75 | GC2 | 0.8915 |
76 | FCW | 0.8912 |
77 | S98 | 0.8911 |
78 | 3IL | 0.8908 |
79 | MQG | 0.8907 |
80 | OLU | 0.8902 |
81 | Y0V | 0.8902 |
82 | NIY | 0.8896 |
83 | 96Z | 0.8895 |
84 | 9H2 | 0.8892 |
85 | XCG | 0.8885 |
86 | 2P3 | 0.8884 |
87 | ZHA | 0.8883 |
88 | BHS | 0.8883 |
89 | 2GQ | 0.8882 |
90 | PXP | 0.8881 |
91 | JA5 | 0.8880 |
92 | 9KZ | 0.8878 |
93 | IFG | 0.8877 |
94 | OQC | 0.8876 |
95 | S0G | 0.8875 |
96 | DHC | 0.8873 |
97 | ALE | 0.8870 |
98 | NGA | 0.8870 |
99 | FYR | 0.8870 |
100 | I2E | 0.8867 |
101 | MP5 | 0.8866 |
102 | 1QV | 0.8864 |
103 | 8NB | 0.8858 |
104 | HC4 | 0.8858 |
105 | 0J5 | 0.8857 |
106 | SIZ | 0.8851 |
107 | K7H | 0.8850 |
108 | BNX | 0.8849 |
109 | TMG | 0.8846 |
110 | 3TC | 0.8845 |
111 | QUB | 0.8844 |
112 | 7AP | 0.8841 |
113 | F40 | 0.8841 |
114 | FF2 | 0.8840 |
115 | Q5M | 0.8837 |
116 | 4R1 | 0.8829 |
117 | EV2 | 0.8829 |
118 | 9BF | 0.8827 |
119 | 92O | 0.8820 |
120 | BEU | 0.8819 |
121 | ZIP | 0.8819 |
122 | KWB | 0.8818 |
123 | SSY | 0.8816 |
124 | SYE | 0.8815 |
125 | AU8 | 0.8815 |
126 | 4BX | 0.8814 |
127 | BG6 | 0.8814 |
128 | 3LJ | 0.8813 |
129 | X48 | 0.8812 |
130 | X04 | 0.8808 |
131 | 3VX | 0.8808 |
132 | BGU | 0.8808 |
133 | Z25 | 0.8807 |
134 | CTE | 0.8807 |
135 | P4L | 0.8805 |
136 | HH6 | 0.8801 |
137 | JCZ | 0.8800 |
138 | 6HP | 0.8799 |
139 | 0J2 | 0.8796 |
140 | ZRK | 0.8795 |
141 | NEU | 0.8792 |
142 | 16G | 0.8790 |
143 | 2PV | 0.8786 |
144 | RK4 | 0.8786 |
145 | 2KU | 0.8785 |
146 | KYN | 0.8783 |
147 | 2PK | 0.8782 |
148 | GJG | 0.8780 |
149 | A2G | 0.8778 |
150 | F5C | 0.8774 |
151 | 8V8 | 0.8772 |
152 | 5M2 | 0.8771 |
153 | CXH | 0.8770 |
154 | TNX | 0.8768 |
155 | 363 | 0.8767 |
156 | 1V4 | 0.8765 |
157 | 4QY | 0.8762 |
158 | AMR | 0.8762 |
159 | GZV | 0.8759 |
160 | NFM | 0.8758 |
161 | 1Q1 | 0.8758 |
162 | L03 | 0.8755 |
163 | IPO | 0.8755 |
164 | 1XS | 0.8754 |
165 | 78U | 0.8753 |
166 | GJK | 0.8753 |
167 | NGS | 0.8748 |
168 | HWD | 0.8747 |
169 | C9M | 0.8745 |
170 | CFA | 0.8743 |
171 | 0XR | 0.8741 |
172 | 5ER | 0.8739 |
173 | 88R | 0.8738 |
174 | RVE | 0.8738 |
175 | CHQ | 0.8734 |
176 | BDI | 0.8733 |
177 | P81 | 0.8731 |
178 | 8D6 | 0.8725 |
179 | K3D | 0.8725 |
180 | CC5 | 0.8723 |
181 | A9K | 0.8722 |
182 | DVK | 0.8721 |
183 | 4Z9 | 0.8720 |
184 | SX2 | 0.8720 |
185 | ZYQ | 0.8717 |
186 | 2F8 | 0.8716 |
187 | PW5 | 0.8710 |
188 | ZYC | 0.8710 |
189 | B15 | 0.8709 |
190 | 5SJ | 0.8708 |
191 | 80G | 0.8707 |
192 | DL6 | 0.8707 |
193 | EYY | 0.8707 |
194 | PZP | 0.8705 |
195 | N91 | 0.8705 |
196 | IYR | 0.8704 |
197 | EYJ | 0.8699 |
198 | 9FH | 0.8693 |
199 | JPQ | 0.8692 |
200 | 3L1 | 0.8691 |
201 | GF4 | 0.8690 |
202 | 1V3 | 0.8688 |
203 | E9S | 0.8686 |
204 | EE8 | 0.8685 |
205 | C53 | 0.8684 |
206 | 7MW | 0.8683 |
207 | LO1 | 0.8682 |
208 | 2LT | 0.8681 |
209 | TYC | 0.8673 |
210 | D8Q | 0.8670 |
211 | H4E | 0.8668 |
212 | C0W | 0.8667 |
213 | UQ1 | 0.8667 |
214 | 4Z1 | 0.8664 |
215 | 36M | 0.8658 |
216 | ITE | 0.8654 |
217 | CDY | 0.8653 |
218 | J27 | 0.8652 |
219 | 6Q3 | 0.8649 |
220 | A6W | 0.8648 |
221 | 250 | 0.8645 |
222 | BBY | 0.8645 |
223 | SNG | 0.8644 |
224 | 50C | 0.8643 |
225 | RKN | 0.8639 |
226 | 9VZ | 0.8639 |
227 | 856 | 0.8636 |
228 | WA2 | 0.8636 |
229 | 2CZ | 0.8635 |
230 | QIF | 0.8634 |
231 | LOG | 0.8631 |
232 | NG6 | 0.8628 |
233 | 5TT | 0.8628 |
234 | 3D1 | 0.8627 |
235 | A6P | 0.8624 |
236 | 3XR | 0.8621 |
237 | 86L | 0.8620 |
238 | EQW | 0.8620 |
239 | 5GV | 0.8620 |
240 | 52F | 0.8619 |
241 | 657 | 0.8616 |
242 | 3W6 | 0.8611 |
243 | 3W3 | 0.8611 |
244 | 3Y7 | 0.8611 |
245 | C93 | 0.8611 |
246 | 5WT | 0.8609 |
247 | A5P | 0.8608 |
248 | 2QC | 0.8603 |
249 | RUG | 0.8598 |
250 | ALJ | 0.8598 |
251 | R4E | 0.8594 |
252 | B5A | 0.8594 |
253 | DTR | 0.8593 |
254 | MAG | 0.8589 |
255 | 6PG | 0.8588 |
256 | JY2 | 0.8572 |
257 | RPN | 0.8572 |
258 | AC2 | 0.8570 |
259 | J38 | 0.8561 |
260 | IOS | 0.8559 |
261 | 1HR | 0.8551 |
262 | NPL | 0.8548 |
263 | 5S9 | 0.8544 |
264 | MUX | 0.8540 |
265 | A7K | 0.8538 |
266 | 6N4 | 0.8535 |
This union binding pocket(no: 1) in the query (biounit: 4gvf.bio1) has 16 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 4gvf.bio1) has 16 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 4gvf.bio2) has 18 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 4gvf.bio2) has 18 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |