- 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 17 families. | |||||
1 | 1FH7 | Ki = 5.8 uM | XYP XDN | n/a | n/a |
2 | 1FHD | Ki = 0.15 uM | XYP XIM | n/a | n/a |
3 | 1FH8 | Ki = 0.13 uM | XYP XIF | n/a | n/a |
4 | 1J01 | Ki = 0.34 uM | XIL | C10 H17 N O7 | C1CNC(=O)[.... |
5 | 1FH9 | Ki = 0.37 uM | LOX XYP | n/a | n/a |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 19 families. | |||||
1 | 1V0M | - | XDN XYP | n/a | n/a |
2 | 1V0N | - | XIF XYP | n/a | n/a |
3 | 1V0K | Ki = 40 uM | XYP XDN | n/a | n/a |
4 | 1V0L | Ki = 480 nM | XIF XYP | n/a | n/a |
5 | 1OD8 | - | XDL XYP | n/a | n/a |
6 | 3W25 | - | XYP XYP | n/a | n/a |
7 | 3W27 | - | XYS XYP | n/a | n/a |
8 | 3W26 | - | XYP XYP XYP | n/a | n/a |
9 | 3W29 | - | XYS XYP XYP XYP | n/a | n/a |
10 | 3W28 | - | XYS XYP XYP | n/a | n/a |
11 | 1B30 | - | XYP XYP XYP | n/a | n/a |
12 | 1B3V | - | XYS | C5 H10 O5 | C1[C@H]([C.... |
13 | 1B3Y | - | XYS | C5 H10 O5 | C1[C@H]([C.... |
14 | 1B3X | - | XYP XYP XYP | n/a | n/a |
15 | 1B3Z | - | XYP XYP XYP | n/a | n/a |
16 | 1ISY | - | BGC | C6 H12 O6 | C([C@@H]1[.... |
17 | 1V6W | - | XYP XYP | n/a | n/a |
18 | 1ISX | - | XYP XYP | n/a | n/a |
19 | 1ISZ | - | GAL | C6 H12 O6 | C([C@@H]1[.... |
20 | 1V6U | - | XYP XYP | n/a | n/a |
21 | 1V6X | - | XYP XYP | n/a | n/a |
22 | 1V6V | - | XYP XYP | n/a | n/a |
23 | 2D24 | - | XYS XYS | n/a | n/a |
24 | 2D23 | - | XYS AZI XYS | n/a | n/a |
25 | 1IT0 | - | BGC GAL | n/a | n/a |
26 | 1ISW | - | XYP XYP | n/a | n/a |
27 | 2D20 | - | NPO | C6 H5 N O3 | c1cc(ccc1[.... |
28 | 1ISV | - | XYP | C5 H10 O5 | C1[C@H]([C.... |
29 | 3EMZ | - | HXH | C19 H21 N O4 | c1ccc(cc1).... |
30 | 3WUE | - | XYP | C5 H10 O5 | C1[C@H]([C.... |
31 | 3WUG | - | XYP | C5 H10 O5 | C1[C@H]([C.... |
32 | 1FH7 | Ki = 5.8 uM | XYP XDN | n/a | n/a |
33 | 1FHD | Ki = 0.15 uM | XYP XIM | n/a | n/a |
34 | 1FH8 | Ki = 0.13 uM | XYP XIF | n/a | n/a |
35 | 1J01 | Ki = 0.34 uM | XIL | C10 H17 N O7 | C1CNC(=O)[.... |
36 | 1FH9 | Ki = 0.37 uM | LOX XYP | n/a | n/a |
37 | 5D4Y | - | XYP XYP | n/a | n/a |
38 | 2FGL | - | XYS XYS | n/a | n/a |
39 | 3NJ3 | - | XYP XYP | n/a | n/a |
40 | 1VBR | - | XYP XYS | n/a | n/a |
41 | 2BNJ | - | XYP XYP AHR FER | n/a | n/a |
42 | 7K4X | Kd = 13.04 uM | 6NT | C6 H4 N4 O2 | c1cc2c(cc1.... |
43 | 5RGA | - | 6NT | C6 H4 N4 O2 | c1cc2c(cc1.... |
44 | 7K4Z | - | 6NT | C6 H4 N4 O2 | c1cc2c(cc1.... |
45 | 1GOR | - | XYS XYP | n/a | n/a |
46 | 7K4Q | Kd = 372.5 uM | 6NT | C6 H4 N4 O2 | c1cc2c(cc1.... |
47 | 5RGD | - | 6NT | C6 H4 N4 O2 | c1cc2c(cc1.... |
48 | 7K4U | - | 6NT | C6 H4 N4 O2 | c1cc2c(cc1.... |
49 | 5RGC | - | 6NT | C6 H4 N4 O2 | c1cc2c(cc1.... |
50 | 4BS0 | Ki = 2 uM | 6NT | C6 H4 N4 O2 | c1cc2c(cc1.... |
51 | 3NYD | - | 3NY | C6 H4 N4 O2 | c1cc2c(cc1.... |
52 | 5RGB | - | 6NT | C6 H4 N4 O2 | c1cc2c(cc1.... |
53 | 5RGE | - | 6NT | C6 H4 N4 O2 | c1cc2c(cc1.... |
54 | 1GOQ | - | XYP XYP | n/a | n/a |
55 | 5RGF | - | 6NT | C6 H4 N4 O2 | c1cc2c(cc1.... |
56 | 1UQY | - | XYP XYP XYP XYP | n/a | n/a |
57 | 1UR1 | - | XYS XYP AHR | n/a | n/a |
58 | 1UQZ | - | XYP XYP XYP GCV | n/a | n/a |
59 | 3RDK | - | XYS XYP XYP GCV | n/a | n/a |
60 | 5OFK | - | XYP XYP XYP XYP XYP XYP XYP | n/a | n/a |
61 | 5OFL | Ka = 17500 M^-1 | BGC BGC BGC BGC BGC BGC | n/a | n/a |
62 | 1R87 | - | XYP XYP | n/a | n/a |
63 | 1HIZ | - | GLC | C6 H12 O6 | C([C@@H]1[.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | XYP XIM | 0.9754 |
2 | XYP XYP | 0.9719 |
3 | XYS AZI XYS | 0.9632 |
4 | XYS XYS | 0.9561 |
5 | XYP XYS | 0.9305 |
6 | XDN XYP | 0.9290 |
7 | TCL | 0.9243 |
8 | XYS XYP | 0.9237 |
9 | XIF XYP | 0.9163 |
10 | FT1 | 0.9148 |
11 | LU2 | 0.9105 |
12 | ADN | 0.9102 |
13 | KUP | 0.9073 |
14 | B4L | 0.9065 |
15 | DCN | 0.9060 |
16 | FT3 | 0.9050 |
17 | NOC | 0.9049 |
18 | FB4 | 0.9041 |
19 | CHJ | 0.9034 |
20 | ARJ | 0.8996 |
21 | 5CK | 0.8992 |
22 | P2L | 0.8983 |
23 | CMP | 0.8978 |
24 | WCU | 0.8961 |
25 | BMC | 0.8950 |
26 | NXB | 0.8946 |
27 | 5R9 | 0.8945 |
28 | JPB | 0.8941 |
29 | MTA | 0.8937 |
30 | U14 | 0.8923 |
31 | FT2 | 0.8914 |
32 | TYP | 0.8914 |
33 | 8OB | 0.8904 |
34 | LI4 | 0.8903 |
35 | 3Q0 | 0.8902 |
36 | 5FD | 0.8902 |
37 | CC7 | 0.8899 |
38 | AFX | 0.8898 |
39 | 6SW | 0.8893 |
40 | YUG | 0.8882 |
41 | 7ZO | 0.8862 |
42 | 8WB | 0.8856 |
43 | 5CD | 0.8845 |
44 | WDW | 0.8838 |
45 | T5J | 0.8833 |
46 | 7CH | 0.8831 |
47 | EMU | 0.8831 |
48 | MMA XYP | 0.8824 |
49 | 2GE | 0.8820 |
50 | 3L1 | 0.8818 |
51 | AX8 | 0.8814 |
52 | C4F | 0.8812 |
53 | 5AD | 0.8799 |
54 | TGW | 0.8797 |
55 | 97K | 0.8791 |
56 | 9W7 | 0.8790 |
57 | 8M5 | 0.8787 |
58 | AGI | 0.8787 |
59 | Y3J | 0.8782 |
60 | 4KN | 0.8781 |
61 | BGC BGC | 0.8775 |
62 | DZ2 | 0.8774 |
63 | A45 | 0.8772 |
64 | 6SX | 0.8771 |
65 | AD3 | 0.8768 |
66 | AJ6 | 0.8767 |
67 | LVY | 0.8767 |
68 | JA3 | 0.8767 |
69 | 6SY | 0.8763 |
70 | TCC | 0.8763 |
71 | QRP | 0.8759 |
72 | IDC | 0.8758 |
73 | J47 | 0.8754 |
74 | SP1 | 0.8751 |
75 | 2J5 | 0.8751 |
76 | 6JP | 0.8750 |
77 | 6QT | 0.8749 |
78 | 27M | 0.8749 |
79 | 122 | 0.8746 |
80 | QEI | 0.8745 |
81 | 6DQ | 0.8744 |
82 | PNJ | 0.8734 |
83 | PNW | 0.8734 |
84 | PNG | 0.8730 |
85 | LVB | 0.8730 |
86 | 8OE | 0.8729 |
87 | 51Y | 0.8729 |
88 | KXN | 0.8729 |
89 | 6H2 | 0.8726 |
90 | 6BK | 0.8724 |
91 | 5N5 | 0.8721 |
92 | 147 | 0.8720 |
93 | NOS | 0.8716 |
94 | DS8 | 0.8711 |
95 | MQ1 | 0.8709 |
96 | VIB | 0.8709 |
97 | D59 | 0.8707 |
98 | EP4 | 0.8706 |
99 | EZB | 0.8705 |
100 | 9ME | 0.8696 |
101 | AJ4 | 0.8695 |
102 | GAT | 0.8695 |
103 | A | 0.8692 |
104 | VJJ | 0.8691 |
105 | 6FX | 0.8690 |
106 | BMZ | 0.8688 |
107 | 4CN | 0.8687 |
108 | 5F1 | 0.8683 |
109 | KHP | 0.8681 |
110 | CWE | 0.8681 |
111 | 4L2 | 0.8680 |
112 | 7W7 | 0.8679 |
113 | 15Q | 0.8674 |
114 | 833 | 0.8670 |
115 | AX5 | 0.8664 |
116 | ISX | 0.8652 |
117 | NOJ BGC | 0.8651 |
118 | 38E | 0.8648 |
119 | MTP | 0.8639 |
120 | BGK | 0.8639 |
121 | JAD | 0.8639 |
122 | EAT | 0.8639 |
123 | 4K2 | 0.8638 |
124 | ESE | 0.8635 |
125 | IXG | 0.8630 |
126 | 4YE | 0.8629 |
127 | 4GU | 0.8627 |
128 | IMH | 0.8627 |
129 | 3D1 | 0.8624 |
130 | NKI | 0.8624 |
131 | TOP | 0.8623 |
132 | GLC IFM | 0.8622 |
133 | CJZ | 0.8620 |
134 | PCG | 0.8620 |
135 | UMF | 0.8617 |
136 | MQR | 0.8614 |
137 | DSQ | 0.8611 |
138 | TCT | 0.8611 |
139 | 43F | 0.8609 |
140 | KTM | 0.8608 |
141 | DX6 | 0.8604 |
142 | XYP AHR | 0.8603 |
143 | ZW2 | 0.8603 |
144 | UA2 | 0.8602 |
145 | 0X2 | 0.8596 |
146 | H0V | 0.8594 |
147 | 7QY | 0.8578 |
148 | C4E | 0.8576 |
149 | GLC DMJ | 0.8573 |
150 | TBN | 0.8570 |
151 | QC1 | 0.8570 |
152 | RPP | 0.8567 |
153 | 2FA | 0.8565 |
154 | CHV | 0.8561 |
155 | 6WR | 0.8561 |
156 | 35G | 0.8558 |
157 | GLC GAL | 0.8551 |
158 | 3WO | 0.8521 |
159 | 3WN | 0.8521 |
This union binding pocket(no: 1) in the query (biounit: 1fh8.bio1) has 15 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 4PMZ | XYP XYP | 35.3135 |
2 | 2WZE | XYP XYP XYP | 48.7179 |
3 | 2W5F | XYP XYP XYP | 49.359 |