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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 3 families. | |||||
1 | 3FJX | - | S3P | C7 H11 O8 P | C1[C@H]([C.... |
2 | 1MI4 | - | S3P | C7 H11 O8 P | C1[C@H]([C.... |
3 | 1X8T | Ki = 16 nM | RC1 | C10 H16 O13 P2 | C[C@@](C(=.... |
4 | 3FJZ | Ki = 90 uM | GPF | C3 H8 N O5 P | C(C(=O)O)N.... |
5 | 2AAY | ic50 = 1.7 mM | GPJ | C3 H9 N O5 P | C(C(=O)O)[.... |
6 | 2AA9 | - | SKM | C7 H10 O5 | C1[C@H]([C.... |
7 | 1G6S | - | GPJ | C3 H9 N O5 P | C(C(=O)O)[.... |
8 | 3FK1 | Ki = 2420 uM | GPF | C3 H8 N O5 P | C(C(=O)O)N.... |
9 | 1X8R | Ki = 2.9 uM | SC1 | C10 H16 O13 P2 | C[C@](C(=O.... |
10 | 2QFT | Ki = 5.5 uM | S3P | C7 H11 O8 P | C1[C@H]([C.... |
11 | 1G6T | - | S3P | C7 H11 O8 P | C1[C@H]([C.... |
12 | 2QFQ | ic50 = 66 uM | S3P | C7 H11 O8 P | C1[C@H]([C.... |
13 | 2QFS | Ki = 5.5 uM | S3P | C7 H11 O8 P | C1[C@H]([C.... |
14 | 3FK0 | - | S3P | C7 H11 O8 P | C1[C@H]([C.... |
15 | 2PQ9 | Ki = 7.8 nM | GG9 | C10 H14 F2 O14 P2 | C1[C@H]([C.... |
16 | 2QFU | Ki = 66 uM | S3P | C7 H11 O8 P | C1[C@H]([C.... |
17 | 1Q36 | - | SKP | C10 H16 O14 P2 | C[C@](C(=O.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 2 families. | |||||
1 | 3FJX | - | S3P | C7 H11 O8 P | C1[C@H]([C.... |
2 | 1MI4 | - | S3P | C7 H11 O8 P | C1[C@H]([C.... |
3 | 1X8T | Ki = 16 nM | RC1 | C10 H16 O13 P2 | C[C@@](C(=.... |
4 | 3FJZ | Ki = 90 uM | GPF | C3 H8 N O5 P | C(C(=O)O)N.... |
5 | 2AAY | ic50 = 1.7 mM | GPJ | C3 H9 N O5 P | C(C(=O)O)[.... |
6 | 2AA9 | - | SKM | C7 H10 O5 | C1[C@H]([C.... |
7 | 1G6S | - | GPJ | C3 H9 N O5 P | C(C(=O)O)[.... |
8 | 3FK1 | Ki = 2420 uM | GPF | C3 H8 N O5 P | C(C(=O)O)N.... |
9 | 1X8R | Ki = 2.9 uM | SC1 | C10 H16 O13 P2 | C[C@](C(=O.... |
10 | 2QFT | Ki = 5.5 uM | S3P | C7 H11 O8 P | C1[C@H]([C.... |
11 | 1G6T | - | S3P | C7 H11 O8 P | C1[C@H]([C.... |
12 | 2QFQ | ic50 = 66 uM | S3P | C7 H11 O8 P | C1[C@H]([C.... |
13 | 2QFS | Ki = 5.5 uM | S3P | C7 H11 O8 P | C1[C@H]([C.... |
14 | 3FK0 | - | S3P | C7 H11 O8 P | C1[C@H]([C.... |
15 | 2PQ9 | Ki = 7.8 nM | GG9 | C10 H14 F2 O14 P2 | C1[C@H]([C.... |
16 | 2QFU | Ki = 66 uM | S3P | C7 H11 O8 P | C1[C@H]([C.... |
17 | 1Q36 | - | SKP | C10 H16 O14 P2 | C[C@](C(=O.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | CSN | 0.9257 |
2 | G1P | 0.9152 |
3 | CRB | 0.9118 |
4 | MZM | 0.9117 |
5 | EYA | 0.9055 |
6 | EYM | 0.9054 |
7 | R8Y | 0.9050 |
8 | QMS | 0.9041 |
9 | 5OF | 0.9034 |
10 | 4XY | 0.9012 |
11 | T6Z | 0.9012 |
12 | NBG | 0.9010 |
13 | KFN | 0.9009 |
14 | LF5 | 0.8990 |
15 | VM1 | 0.8971 |
16 | NLA | 0.8934 |
17 | GL1 | 0.8929 |
18 | ISJ | 0.8921 |
19 | DNC | 0.8920 |
20 | FWB | 0.8916 |
21 | CR1 | 0.8909 |
22 | 1X8 | 0.8903 |
23 | OX2 | 0.8901 |
24 | KED | 0.8899 |
25 | EY7 | 0.8895 |
26 | U7E | 0.8877 |
27 | M3Q | 0.8872 |
28 | GN1 | 0.8871 |
29 | 1PL | 0.8870 |
30 | MUR | 0.8867 |
31 | MYI | 0.8865 |
32 | 7I2 | 0.8864 |
33 | I7A | 0.8863 |
34 | IPT | 0.8860 |
35 | 0GY | 0.8856 |
36 | R1P | 0.8835 |
37 | CG8 | 0.8833 |
38 | JAA | 0.8833 |
39 | 6DP | 0.8824 |
40 | LEL | 0.8817 |
41 | EWG | 0.8816 |
42 | M1P | 0.8802 |
43 | 7FF | 0.8801 |
44 | DG2 | 0.8795 |
45 | 5F5 | 0.8779 |
46 | 15A | 0.8777 |
47 | AZM | 0.8777 |
48 | MNP | 0.8772 |
49 | 772 | 0.8771 |
50 | MB1 | 0.8770 |
51 | OKM | 0.8768 |
52 | 790 | 0.8766 |
53 | 4AV | 0.8766 |
54 | NQM | 0.8766 |
55 | TQU | 0.8764 |
56 | A0O | 0.8764 |
57 | I7B | 0.8763 |
58 | ASG | 0.8758 |
59 | 7WR | 0.8758 |
60 | 512 | 0.8757 |
61 | BN1 | 0.8757 |
62 | 6R8 | 0.8754 |
63 | I4D | 0.8749 |
64 | 2UZ | 0.8749 |
65 | TWB | 0.8741 |
66 | AVA | 0.8740 |
67 | 2J9 | 0.8734 |
68 | KDO | 0.8734 |
69 | HLD | 0.8732 |
70 | 2VQ | 0.8725 |
71 | 5F8 | 0.8725 |
72 | ZON | 0.8723 |
73 | 982 | 0.8718 |
74 | HCA | 0.8711 |
75 | NPA | 0.8705 |
76 | PMV | 0.8704 |
77 | RD4 | 0.8703 |
78 | F1X | 0.8699 |
79 | 7ZC | 0.8696 |
80 | CE2 | 0.8694 |
81 | 8WZ | 0.8690 |
82 | HJ7 | 0.8681 |
83 | IOS | 0.8680 |
84 | LIP | 0.8680 |
85 | U1K | 0.8679 |
86 | EDM | 0.8679 |
87 | 8VE | 0.8679 |
88 | DNF | 0.8676 |
89 | GFP | 0.8674 |
90 | G01 | 0.8674 |
91 | TNF | 0.8673 |
92 | NLQ | 0.8671 |
93 | 5PX | 0.8668 |
94 | 2O6 | 0.8663 |
95 | 774 | 0.8658 |
96 | NLG | 0.8650 |
97 | BOQ | 0.8644 |
98 | SRO | 0.8644 |
99 | BB4 | 0.8643 |
100 | N8Q | 0.8642 |
101 | 4A5 | 0.8641 |
102 | PA5 | 0.8640 |
103 | KYA | 0.8637 |
104 | 0GZ | 0.8636 |
105 | FUJ | 0.8635 |
106 | 5FL | 0.8634 |
107 | OAI | 0.8634 |
108 | CPW | 0.8634 |
109 | JV4 | 0.8633 |
110 | JVA | 0.8630 |
111 | ALA GLU | 0.8623 |
112 | JR2 | 0.8620 |
113 | X6P | 0.8620 |
114 | TXW | 0.8610 |
115 | GPM | 0.8609 |
116 | IBM | 0.8608 |
117 | TA6 | 0.8602 |
118 | CIT | 0.8601 |
119 | 692 | 0.8596 |
120 | B4O | 0.8595 |
121 | 8GK | 0.8592 |
122 | W8G | 0.8592 |
123 | 2V0 | 0.8585 |
124 | GNL | 0.8583 |
125 | SG2 | 0.8580 |
126 | AVO | 0.8572 |
127 | 1X7 | 0.8563 |
128 | 2D3 | 0.8561 |
129 | BK9 | 0.8559 |
130 | MS0 | 0.8534 |
131 | TNL | 0.8533 |
This union binding pocket(no: 1) in the query (biounit: 2pq9.bio1) has 26 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |