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- PDB : .ZIP | .CSV
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- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 1E81 | - | M91 | C34 H49 N5 O6 S | CSC[C@@H](.... |
2 | 4ZEA | - | IMI | C10 H17 N3 O2 S | C1[C@H]2[C.... |
3 | 3ER3 | Ki = 81 nM | 0EL | C51 H78 N8 O9 | NULL |
4 | 4Y4D | - | CFF | C8 H10 N4 O2 | Cn1cnc2c1C.... |
5 | 5LWT | - | 7B3 | C10 H13 N3 O | Cc1c2cnnc(.... |
6 | 1EPM | - | THR PHE GLN ALA PSA LEU ARG GLU | n/a | n/a |
7 | 1EED | Ki = 16.2 uM | 0EO | C34 H55 N3 O8 | CC(C)C[C@@.... |
8 | 3PMY | - | 41L | C15 H13 N3 O | c1ccc(cc1).... |
9 | 1OEX | - | BOC HIS PRO PHE ALA LOV ILE HIS | n/a | n/a |
10 | 4ER4 | Ki = 160 nM | PRO HIS PRO PHE HIS LAV ILE HIS LYS | n/a | n/a |
11 | 4LBT | Ki = 6 uM | 1TZ | C21 H24 N4 O | Cc1cc(c(c(.... |
12 | 3PWW | - | ROC | C38 H50 N6 O5 | CC(C)(C)NC.... |
13 | 4Y38 | Kd = 4 mM | 0A9 | C10 H13 N O2 | COC(=O)[C@.... |
14 | 2JJJ | - | 0QS | C36 H56 F2 N7 O8 S | CC(C)(C)S(.... |
15 | 1GVV | - | 0GM | C51 H61 N5 O6 | CC(C)C[C@H.... |
16 | 3PMU | - | F7L | C14 H20 F N O2 | c1ccc(c(c1.... |
17 | 5OJE | Ki = 6.1 uM | VSK | C22 H27 N3 O | Cc1cc(c(c(.... |
18 | 1GVT | - | 2ZS | C31 H48 N4 O7 S | CC(C)OC(=O.... |
19 | 1EPR | - | 0QS | C36 H56 F2 N7 O8 S | CC(C)(C)S(.... |
20 | 5MB5 | - | 46P | C8 H10 N4 S | Cc1c(sc(n1.... |
21 | 5MB7 | - | 4AV | C8 H9 Cl N2 O2 | CNCc1cc(cc.... |
22 | 4Y4G | - | GGB | C5 H12 N4 O3 | [H]/N=C(N).... |
23 | 3ER5 | Ki = 1 nM | PRO HIS PRO PHE HIS STA VAL ILE HIS LYS | n/a | n/a |
24 | 3URL | - | HIS SER LEU PHE HIS PUK THR PRO | n/a | n/a |
25 | 3PCZ | - | BAM | C7 H9 N2 | c1ccc(cc1).... |
26 | 2V00 | Kd = 0.22 mM | V15 | C12 H13 N3 O | c1ccc(cc1).... |
27 | 5LWR | - | 7B2 | C27 H29 Cl N9 O | Cc1c2cnn3c.... |
28 | 3PLL | - | F06 | C8 H9 Cl N2 S | [H]/N=C(N).... |
29 | 4ER2 | Ki = 0.5 nM | IVA VAL VAL STA ALA STA | n/a | n/a |
30 | 4LP9 | ic50 = 0.62 uM | SER LEU PHE HIS 22G THR PRO | n/a | n/a |
31 | 3PRS | - | RIT | C37 H48 N6 O5 S2 | CC(C)c1nc(.... |
32 | 1ENT | Ki = 110 nM | 0EM | C32 H52 N6 O7 P | NULL |
33 | 1E80 | - | 0GQ | C41 H64 N10 O6 | CC[C@H](C).... |
34 | 5LWS | - | 7B2 | C27 H29 Cl N9 O | Cc1c2cnn3c.... |
35 | 3PBD | - | F05 | C8 H8 N2 | c1ccc2c(c1.... |
36 | 1OD1 | - | 0QS | C36 H56 F2 N7 O8 S | CC(C)(C)S(.... |
37 | 3WZ6 | Ki = 1.1 uM | IXZ | C27 H25 N3 O2 S | c1ccc(cc1).... |
38 | 5ER1 | Ki = 960 nM | 0HT | C28 H48 N4 O5 | CC[C@H](C).... |
39 | 1OEW | - | SER THR | n/a | n/a |
40 | 1EPQ | Ki = 6.5 nM | 0QF | C31 H52 N4 O7 S2 | CCS[C@@H](.... |
41 | 5MB3 | - | 5GL | C13 H20 N2 O S | CCCN1C2=C(.... |
42 | 2JJI | - | 0QS | C36 H56 F2 N7 O8 S | CC(C)(C)S(.... |
43 | 3PCW | - | FBF | C8 H7 F3 N2 | [H]/N=C(/c.... |
44 | 3PGI | - | F41 | C14 H18 N2 O3 | c1cc2c(cc1.... |
45 | 4Y3J | Kd = 6.8 mM | HIC | C7 H11 N3 O2 | Cn1cc(nc1).... |
46 | 1GVW | Ki = 110 nM | 0EM | C32 H52 N6 O7 P | NULL |
47 | 5ER2 | Ki = 0.27 uM | 0EK | C50 H77 N9 O9 | NULL |
48 | 1EPP | Ki = 69 nM | 1Z1 | C32 H57 N7 O6 S2 | CC[C@H](C).... |
49 | 2ER7 | ic50 = 0.7 nM | BOC HIS PRO PHE HIS LOV ILE HIS | n/a | n/a |
50 | 4KUP | Ki = 6 uM | 1TZ | C21 H24 N4 O | Cc1cc(c(c(.... |
51 | 3WZ7 | Ki = 1.8 uM | IXY | C28 H30 N4 O2 S | c1ccc(cc1).... |
52 | 1EPO | Ki = 11 nM | 2Z3 | C32 H49 F2 N5 O7 | NULL |
53 | 1ER8 | - | DHI PRO PHE HIS LEU LEU VAL TYR | n/a | n/a |
54 | 3WZ8 | Ki = 1.5 uM | IXV | C27 H25 N3 O2 S | c1ccc(cc1).... |
55 | 3PI0 | - | F91 | C14 H14 N2 O2 | c1cc2c(cc1.... |
56 | 1GVU | Ki = 1 nM | PRO HIS PRO PHE HIS STA VAL ILE HIS LYS | n/a | n/a |
57 | 1EPL | - | PRO LEU GLU PSA ARG LEU | n/a | n/a |
58 | 4Y3Y | Kd = 4.5 mM | DCL | C6 H15 N O | CC(C)C[C@@.... |
59 | 1E5O | - | 3AI | C23 H38 N4 O4 S | CC[C@H](C).... |
60 | 3PLD | - | F90 | C8 H9 Cl N2 S | [H]/N=C(N).... |
61 | 5MB0 | Kd = 1.4 mM | F91 | C14 H14 N2 O2 | c1cc2c(cc1.... |
62 | 2ER6 | Ki = 60 nM | PRO THR GLU PUK ARG GLU | n/a | n/a |
63 | 3URI | - | HIS PRO HIS LEU SER 13E ALA HIS | n/a | n/a |
64 | 4LHH | Ki = 6 uM | 1TZ | C21 H24 N4 O | Cc1cc(c(c(.... |
65 | 4Y48 | - | GLY PRO | n/a | n/a |
66 | 1E82 | - | M90 | C34 H49 N5 O6 S | CSC[C@@H](.... |
67 | 1EPN | - | 2ZS | C31 H48 N4 O7 S | CC(C)OC(=O.... |
68 | 2ER9 | Ki = 40 nM | BOC HIS PRO PHE HIS STA LEU PHE | n/a | n/a |
69 | 4Y4J | Kd = 3.4 mM | LNR | C8 H11 N O3 | c1cc(c(cc1.... |
70 | 1GVX | Ki = 60 nM | PRO THR GLU PUK ARG GLU | n/a | n/a |
71 | 3PM4 | - | F5N | C15 H13 N3 O | c1ccc(cc1).... |
72 | 3PB5 | - | F63 | C11 H12 N2 O2 | CNCc1ccc(o.... |
73 | 4ZE6 | Kd = 3.3 mM | 011 | C7 H15 N O2 | C(CCCN)CCC.... |
74 | 3PBZ | - | F02 | C11 H17 N3 O | CCN(CC)c1c.... |
75 | 4ER1 | Ki = 0.24 uM | 0ZP | C51 H68 N5 O4 | CC[C@H](C).... |
76 | 5RBV | - | RQD | C10 H12 F N O2 | COC(=O)[C@.... |
77 | 5RCG | - | REG | C11 H20 N2 O2 | C1CCC(C1)N.... |
78 | 5R1U | - | T9G | C9 H13 N O | CC[C@H](c1.... |
79 | 5RC3 | - | RAY | C11 H14 F N O3 | COCCOCC(=O.... |
80 | 5R21 | - | R9Y | C11 H16 N2 | CN1CCCc2c1.... |
81 | 5RCE | - | RE4 | C11 H13 N5 | Cc1cc(nc(n.... |
82 | 5RBS | - | R8V | C9 H9 N O2 | CN1[C@H](c.... |
83 | 5RBU | - | R97 | C10 H10 N2 S | Cc1csc(n1).... |
84 | 5R2C | - | RE4 | C11 H13 N5 | Cc1cc(nc(n.... |
85 | 5R20 | - | R9V | C14 H19 N O | c1ccc(cc1).... |
86 | 5RCC | - | RDV | C12 H22 N2 O | C1CCC(C1)C.... |
87 | 5RC4 | - | RB7 | C11 H16 Br N O2 S | Cc1cc(ccc1.... |
88 | 5R25 | - | RBJ | C8 H11 N O | CNCc1ccc(c.... |
89 | 5HCT | Ki = 0.0254 uM | 61P | C30 H30 N8 O2 | c1ccc2c(c1.... |
90 | 5R1W | - | R8Y | C10 H13 N O3 S | CCN(CCC(=O.... |
91 | 5R23 | - | RAY | C11 H14 F N O3 | COCCOCC(=O.... |
92 | 5RC5 | - | RBG | C10 H20 N2 O | CC(C)(C)NC.... |
93 | 5RCB | - | RDM | C12 H15 N O3 | CC(=O)N[C@.... |
94 | 5RC6 | - | RBJ | C8 H11 N O | CNCc1ccc(c.... |
95 | 5RBQ | - | R8P | C8 H9 N O3 | C[C@@H](c1.... |
96 | 5R1V | - | R8S | C5 H8 N4 O | COc1ccnc(n.... |
97 | 5R1Z | - | R9M | C6 H7 N O2 S | c1csc(n1)C.... |
98 | 5R2B | - | RDY | C12 H15 N O4 | C[C@@H](C(.... |
99 | 5RC7 | - | AES | C8 H10 F N O2 S | c1cc(ccc1C.... |
100 | 5RBO | - | R8A | C6 H8 N2 O | c1cc(c(nc1.... |
101 | 5R26 | - | RCV | C10 H13 N O3 | COC(=O)COc.... |
102 | 5R1Y | - | R9J | C11 H15 N O2 | Cc1ccc(cc1.... |
103 | 5RBZ | - | R9S | C9 H11 N O | Cc1ccccc1C.... |
104 | 5R1X | - | RQD | C10 H12 F N O2 | COC(=O)[C@.... |
105 | 5RC8 | - | RCV | C10 H13 N O3 | COC(=O)COc.... |
106 | 5RC9 | - | RD4 | C9 H12 N2 O | [H]/N=C(c1.... |
107 | 5RBY | - | R9M | C6 H7 N O2 S | c1csc(n1)C.... |
108 | 5RCF | - | RE7 | C13 H16 F N3 | C[C@H](c1c.... |
109 | 5R24 | - | RB7 | C11 H16 Br N O2 S | Cc1cc(ccc1.... |
110 | 5R28 | - | RDJ | C9 H15 N3 O2 S | CCNC(=O)CS.... |
111 | 5RBT | - | RA7 | C8 H12 N2 O2 S | c1c(sc(n1).... |
112 | 5RCD | - | RDY | C12 H15 N O4 | C[C@@H](C(.... |
113 | 5RBR | - | R8S | C5 H8 N4 O | COc1ccnc(n.... |
114 | 5R2D | - | REG | C11 H20 N2 O2 | C1CCC(C1)N.... |
115 | 5RC0 | - | R9V | C14 H19 N O | c1ccc(cc1).... |
116 | 5R29 | - | RDM | C12 H15 N O3 | CC(=O)N[C@.... |
117 | 5R1T | - | R8A | C6 H8 N2 O | c1cc(c(nc1.... |
118 | 5R2A | - | RDV | C12 H22 N2 O | C1CCC(C1)C.... |
119 | 5R27 | - | RD4 | C9 H12 N2 O | [H]/N=C(c1.... |
120 | 5RBX | - | R9J | C11 H15 N O2 | Cc1ccc(cc1.... |
121 | 5RC1 | - | R9Y | C11 H16 N2 | CN1CCCc2c1.... |
122 | 5RCA | - | RDJ | C9 H15 N3 O2 S | CCNC(=O)CS.... |
123 | 5R22 | - | RA7 | C8 H12 N2 O2 S | c1c(sc(n1).... |
124 | 5RC2 | - | R8Y | C10 H13 N O3 S | CCN(CCC(=O.... |
125 | 5RBW | - | R9G | C12 H15 N O2 | COc1cccc(c.... |
126 | 5RBP | - | SYG | C9 H13 N O | CC[C@@H](c.... |
127 | 1PPM | Ki = 1600 nM | 0P1 | C29 H40 N3 O9 P | C[C@@H](C(.... |
128 | 2WED | Ki = 0.8 uM | PP6 | C29 H32 N2 O7 P | CC(C)[C@H].... |
129 | 1APU | Ki = 1.6 nM | IVA VAL VAL 32L | n/a | n/a |
130 | 2WEC | Ki = 110 uM | PP5 | C28 H32 N2 O7 P | CC(C)[C@@H.... |
131 | 1APW | Ki = 10 nM | IVA VAL VAL DFI NME | n/a | n/a |
132 | 1PPL | Ki = 2.8 nM | 1Z7 | C30 H50 N3 O8 P | CC(C)C[C@H.... |
133 | 2WEB | Ki = 7.6 uM | PP4 | C28 H32 N2 O7 P | CC(C)[C@@H.... |
134 | 2WEA | - | PP6 | C29 H32 N2 O7 P | CC(C)[C@H].... |
135 | 1BXO | Ki = 0.1 nM | PP7 | C30 H47 N4 O9 P | CC(C)C[C@@.... |
136 | 1APT | - | IVA VAL VAL LTA | n/a | n/a |
137 | 1PPK | Ki = 22 nM | IVV | C24 H46 N3 O7 P | CCOC(=O)C[.... |
138 | 1BXQ | Ki = 42 nM | PP8 | C29 H47 N4 O9 P | CC(C)C[C@H.... |
139 | 1APV | Ki = 1 nM | IVA VAL VAL DFO NME | n/a | n/a |
140 | 1IZE | - | IVA VAL VAL STA ALA STA | n/a | n/a |
141 | 3EMY | - | IVA VAL VAL STA ALA STA | n/a | n/a |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 1E81 | - | M91 | C34 H49 N5 O6 S | CSC[C@@H](.... |
2 | 4ZEA | - | IMI | C10 H17 N3 O2 S | C1[C@H]2[C.... |
3 | 3ER3 | Ki = 81 nM | 0EL | C51 H78 N8 O9 | NULL |
4 | 4Y4D | - | CFF | C8 H10 N4 O2 | Cn1cnc2c1C.... |
5 | 5LWT | - | 7B3 | C10 H13 N3 O | Cc1c2cnnc(.... |
6 | 1EPM | - | THR PHE GLN ALA PSA LEU ARG GLU | n/a | n/a |
7 | 1EED | Ki = 16.2 uM | 0EO | C34 H55 N3 O8 | CC(C)C[C@@.... |
8 | 3PMY | - | 41L | C15 H13 N3 O | c1ccc(cc1).... |
9 | 1OEX | - | BOC HIS PRO PHE ALA LOV ILE HIS | n/a | n/a |
10 | 4ER4 | Ki = 160 nM | PRO HIS PRO PHE HIS LAV ILE HIS LYS | n/a | n/a |
11 | 4LBT | Ki = 6 uM | 1TZ | C21 H24 N4 O | Cc1cc(c(c(.... |
12 | 3PWW | - | ROC | C38 H50 N6 O5 | CC(C)(C)NC.... |
13 | 4Y38 | Kd = 4 mM | 0A9 | C10 H13 N O2 | COC(=O)[C@.... |
14 | 2JJJ | - | 0QS | C36 H56 F2 N7 O8 S | CC(C)(C)S(.... |
15 | 1GVV | - | 0GM | C51 H61 N5 O6 | CC(C)C[C@H.... |
16 | 3PMU | - | F7L | C14 H20 F N O2 | c1ccc(c(c1.... |
17 | 5OJE | Ki = 6.1 uM | VSK | C22 H27 N3 O | Cc1cc(c(c(.... |
18 | 1GVT | - | 2ZS | C31 H48 N4 O7 S | CC(C)OC(=O.... |
19 | 1EPR | - | 0QS | C36 H56 F2 N7 O8 S | CC(C)(C)S(.... |
20 | 5MB5 | - | 46P | C8 H10 N4 S | Cc1c(sc(n1.... |
21 | 5MB7 | - | 4AV | C8 H9 Cl N2 O2 | CNCc1cc(cc.... |
22 | 4Y4G | - | GGB | C5 H12 N4 O3 | [H]/N=C(N).... |
23 | 3ER5 | Ki = 1 nM | PRO HIS PRO PHE HIS STA VAL ILE HIS LYS | n/a | n/a |
24 | 3URL | - | HIS SER LEU PHE HIS PUK THR PRO | n/a | n/a |
25 | 3PCZ | - | BAM | C7 H9 N2 | c1ccc(cc1).... |
26 | 2V00 | Kd = 0.22 mM | V15 | C12 H13 N3 O | c1ccc(cc1).... |
27 | 5LWR | - | 7B2 | C27 H29 Cl N9 O | Cc1c2cnn3c.... |
28 | 3PLL | - | F06 | C8 H9 Cl N2 S | [H]/N=C(N).... |
29 | 4ER2 | Ki = 0.5 nM | IVA VAL VAL STA ALA STA | n/a | n/a |
30 | 4LP9 | ic50 = 0.62 uM | SER LEU PHE HIS 22G THR PRO | n/a | n/a |
31 | 3PRS | - | RIT | C37 H48 N6 O5 S2 | CC(C)c1nc(.... |
32 | 1ENT | Ki = 110 nM | 0EM | C32 H52 N6 O7 P | NULL |
33 | 1E80 | - | 0GQ | C41 H64 N10 O6 | CC[C@H](C).... |
34 | 5LWS | - | 7B2 | C27 H29 Cl N9 O | Cc1c2cnn3c.... |
35 | 3PBD | - | F05 | C8 H8 N2 | c1ccc2c(c1.... |
36 | 1OD1 | - | 0QS | C36 H56 F2 N7 O8 S | CC(C)(C)S(.... |
37 | 3WZ6 | Ki = 1.1 uM | IXZ | C27 H25 N3 O2 S | c1ccc(cc1).... |
38 | 5ER1 | Ki = 960 nM | 0HT | C28 H48 N4 O5 | CC[C@H](C).... |
39 | 1OEW | - | SER THR | n/a | n/a |
40 | 1EPQ | Ki = 6.5 nM | 0QF | C31 H52 N4 O7 S2 | CCS[C@@H](.... |
41 | 5MB3 | - | 5GL | C13 H20 N2 O S | CCCN1C2=C(.... |
42 | 2JJI | - | 0QS | C36 H56 F2 N7 O8 S | CC(C)(C)S(.... |
43 | 3PCW | - | FBF | C8 H7 F3 N2 | [H]/N=C(/c.... |
44 | 3PGI | - | F41 | C14 H18 N2 O3 | c1cc2c(cc1.... |
45 | 4Y3J | Kd = 6.8 mM | HIC | C7 H11 N3 O2 | Cn1cc(nc1).... |
46 | 1GVW | Ki = 110 nM | 0EM | C32 H52 N6 O7 P | NULL |
47 | 5ER2 | Ki = 0.27 uM | 0EK | C50 H77 N9 O9 | NULL |
48 | 1EPP | Ki = 69 nM | 1Z1 | C32 H57 N7 O6 S2 | CC[C@H](C).... |
49 | 2ER7 | ic50 = 0.7 nM | BOC HIS PRO PHE HIS LOV ILE HIS | n/a | n/a |
50 | 4KUP | Ki = 6 uM | 1TZ | C21 H24 N4 O | Cc1cc(c(c(.... |
51 | 3WZ7 | Ki = 1.8 uM | IXY | C28 H30 N4 O2 S | c1ccc(cc1).... |
52 | 1EPO | Ki = 11 nM | 2Z3 | C32 H49 F2 N5 O7 | NULL |
53 | 1ER8 | - | DHI PRO PHE HIS LEU LEU VAL TYR | n/a | n/a |
54 | 3WZ8 | Ki = 1.5 uM | IXV | C27 H25 N3 O2 S | c1ccc(cc1).... |
55 | 3PI0 | - | F91 | C14 H14 N2 O2 | c1cc2c(cc1.... |
56 | 1GVU | Ki = 1 nM | PRO HIS PRO PHE HIS STA VAL ILE HIS LYS | n/a | n/a |
57 | 1EPL | - | PRO LEU GLU PSA ARG LEU | n/a | n/a |
58 | 4Y3Y | Kd = 4.5 mM | DCL | C6 H15 N O | CC(C)C[C@@.... |
59 | 1E5O | - | 3AI | C23 H38 N4 O4 S | CC[C@H](C).... |
60 | 3PLD | - | F90 | C8 H9 Cl N2 S | [H]/N=C(N).... |
61 | 5MB0 | Kd = 1.4 mM | F91 | C14 H14 N2 O2 | c1cc2c(cc1.... |
62 | 2ER6 | Ki = 60 nM | PRO THR GLU PUK ARG GLU | n/a | n/a |
63 | 3URI | - | HIS PRO HIS LEU SER 13E ALA HIS | n/a | n/a |
64 | 4LHH | Ki = 6 uM | 1TZ | C21 H24 N4 O | Cc1cc(c(c(.... |
65 | 4Y48 | - | GLY PRO | n/a | n/a |
66 | 1E82 | - | M90 | C34 H49 N5 O6 S | CSC[C@@H](.... |
67 | 1EPN | - | 2ZS | C31 H48 N4 O7 S | CC(C)OC(=O.... |
68 | 2ER9 | Ki = 40 nM | BOC HIS PRO PHE HIS STA LEU PHE | n/a | n/a |
69 | 4Y4J | Kd = 3.4 mM | LNR | C8 H11 N O3 | c1cc(c(cc1.... |
70 | 1GVX | Ki = 60 nM | PRO THR GLU PUK ARG GLU | n/a | n/a |
71 | 3PM4 | - | F5N | C15 H13 N3 O | c1ccc(cc1).... |
72 | 3PB5 | - | F63 | C11 H12 N2 O2 | CNCc1ccc(o.... |
73 | 4ZE6 | Kd = 3.3 mM | 011 | C7 H15 N O2 | C(CCCN)CCC.... |
74 | 3PBZ | - | F02 | C11 H17 N3 O | CCN(CC)c1c.... |
75 | 4ER1 | Ki = 0.24 uM | 0ZP | C51 H68 N5 O4 | CC[C@H](C).... |
76 | 3OWN | Ki = 34 nM | 3OX | C37 H48 N4 O7 S | CC(C)CNC(=.... |
77 | 2G21 | - | L1B | C19 H24 N5 O | CCc1c(c(nc.... |
78 | 4RYC | ic50 = 0.08 uM | 3ZK | C27 H39 N3 O6 S | Cc1ccc(cc1.... |
79 | 3D91 | Kd = 131 pM | REM | C33 H50 N4 O6 S | CC(C)(C)S(.... |
80 | 1BIL | ic50 = 0.5 nM | 0IU | C34 H53 N5 O5 S | NULL |
81 | 3KM4 | ic50 = 1.3 nM | 22X | C28 H45 Cl N4 O3 | CC(=O)NCCC.... |
82 | 2G24 | - | 7IG | C19 H19 F2 N5 | CCc1c(c(nc.... |
83 | 2IL2 | Kd = 79 nM | LIX | C32 H38 N6 O5 S | CCc1c(c(nc.... |
84 | 5SY3 | ic50 = 43 uM | 74Z | C15 H15 N3 O S | c1cc(oc1)C.... |
85 | 4Q1N | ic50 = 0.2 nM | 2Y9 | C26 H42 N4 O4 | CCOC[C@@H].... |
86 | 2I4Q | ic50 = 0.007 uM | UA4 | C25 H27 F2 N5 O3 | CCc1c(c(nc.... |
87 | 2BKS | ic50 = 37 nM | PZ1 | C34 H41 N3 O6 | COc1ccccc1.... |
88 | 4S1G | Ki = 0.6 nM | 43T | C24 H29 F N4 O2 | C[C@@H](c1.... |
89 | 4XX3 | Ki = 56 nM | 70X | C23 H28 N4 O2 | [H]/N=C1/N.... |
90 | 2G1S | - | 4IG | C24 H25 F2 N5 O3 | CCc1c(c(nc.... |
91 | 2G20 | - | L1A | C33 H50 N6 O7 S2 | CC(C)C[C@@.... |
92 | 5SXN | ic50 = 11 uM | 74U | C19 H15 N3 O | c1ccc(cc1).... |
93 | 3G70 | ic50 = 0.4 nM | A5T | C33 H32 Cl3 F2 N3 O2 | c1cc(c(c(c.... |
94 | 2G1Y | - | 5IG | C20 H27 N5 O3 | CCc1c(c(nc.... |
95 | 2G1R | - | 3IG | C20 H26 N6 O3 | CCc1c(c(nc.... |
96 | 4GJC | ic50 = 0.09 uM | 0MJ | C27 H29 N3 O4 S | Cc1ccc(cc1.... |
97 | 4GJ8 | - | 0LW | C20 H23 N O S | c1ccc2c(c1.... |
98 | 5SY2 | ic50 = 11 uM | 74V | C18 H25 N5 O2 | CCN([C@H]1.... |
99 | 5KOS | ic50 = 1.5 nM | 6VS | C27 H46 N6 O4 | CC(C)CN([C.... |
100 | 3G72 | ic50 = 0.8 nM | A6T | C33 H32 Cl3 F2 N3 O2 | c1cc(c(c(c.... |
101 | 3G6Z | ic50 = 0.2 nM | A7T | C35 H39 Cl2 N3 O3 | Cc1cccc(c1.... |
102 | 3GW5 | ic50 = 0.47 nM | 72X | C28 H46 Cl N3 O3 | CNC[C@H](C.... |
103 | 3SFC | ic50 = 0.003 uM | S53 | C32 H29 F N4 O2 | Cc1ccc(cc1.... |
104 | 2IKO | Kd = 3571 nM | 7IG | C19 H19 F2 N5 | CCc1c(c(nc.... |
105 | 3K1W | - | BFX | C31 H31 Br Cl F N2 O2 | c1ccc(c(c1.... |
106 | 4XX4 | Ki = 44 nM | 70Y | C25 H30 N4 O2 | [H]/N=C1/N.... |
107 | 2FS4 | ic50 = 37 nM | PZ1 | C34 H41 N3 O6 | COc1ccccc1.... |
108 | 2BKT | ic50 = 23 nM | RPF | C31 H37 N3 O5 | COc1ccccc1.... |
109 | 4GJ5 | - | 0LR | C22 H23 N O | c1ccc(cc1).... |
110 | 2G22 | - | 6IG | C27 H35 N5 O | CCc1c(c(nc.... |
111 | 1RNE | ic50 = 2 nM | C60 | C39 H63 N5 O6 S | CCCCNC(=O).... |
112 | 2G26 | - | 3LG | C32 H35 N3 O7 | COc1ccccc1.... |
113 | 4Y6M | - | 48Q | C39 H52 N4 O4 | CCCN(CCC)C.... |
114 | 5YIE | Ki = 5.6 nM | 8VF | C39 H51 N5 O6 S | CCN(CCN)c1.... |
115 | 5YID | Ki = 4 nM | K95 | C37 H44 N4 O6 S2 | CC1([C@H](.... |
116 | 2IGX | - | A1T | C41 H49 N5 O2 | CCCCCc1ccc.... |
117 | 5YIC | Ki = 1.3 nM | 8VO | C37 H45 N5 O6 S2 | CC1([C@H](.... |
118 | 4CKU | ic50 = 0.15 uM | P2F | C38 H52 N4 O6 S | CCCN(CCC)C.... |
119 | 1XDH | - | IVA VAL VAL STA ALA STA | n/a | n/a |
120 | 1LF2 | - | R37 | C32 H41 N3 O4 | Cc1cccc(c1.... |
121 | 5YIB | Ki = 3.3 nM | 8VC | C40 H53 N5 O6 S | Cc1cc(cc(c.... |
122 | 1LEE | - | R36 | C32 H41 N3 O4 | Cc1cccc(c1.... |
123 | 5YIA | Ki = 3 nM | 8V9 | C37 H44 N4 O7 S2 | CC1([C@H](.... |
124 | 1XE5 | - | 5FE | C29 H47 F6 N5 O9 | C[C@@H](C(.... |
125 | 5RBV | - | RQD | C10 H12 F N O2 | COC(=O)[C@.... |
126 | 5RCG | - | REG | C11 H20 N2 O2 | C1CCC(C1)N.... |
127 | 5R1U | - | T9G | C9 H13 N O | CC[C@H](c1.... |
128 | 5RC3 | - | RAY | C11 H14 F N O3 | COCCOCC(=O.... |
129 | 5R21 | - | R9Y | C11 H16 N2 | CN1CCCc2c1.... |
130 | 5RCE | - | RE4 | C11 H13 N5 | Cc1cc(nc(n.... |
131 | 5RBS | - | R8V | C9 H9 N O2 | CN1[C@H](c.... |
132 | 5RBU | - | R97 | C10 H10 N2 S | Cc1csc(n1).... |
133 | 5R2C | - | RE4 | C11 H13 N5 | Cc1cc(nc(n.... |
134 | 5R20 | - | R9V | C14 H19 N O | c1ccc(cc1).... |
135 | 5RCC | - | RDV | C12 H22 N2 O | C1CCC(C1)C.... |
136 | 5RC4 | - | RB7 | C11 H16 Br N O2 S | Cc1cc(ccc1.... |
137 | 5R25 | - | RBJ | C8 H11 N O | CNCc1ccc(c.... |
138 | 5HCT | Ki = 0.0254 uM | 61P | C30 H30 N8 O2 | c1ccc2c(c1.... |
139 | 5R1W | - | R8Y | C10 H13 N O3 S | CCN(CCC(=O.... |
140 | 5R23 | - | RAY | C11 H14 F N O3 | COCCOCC(=O.... |
141 | 5RC5 | - | RBG | C10 H20 N2 O | CC(C)(C)NC.... |
142 | 5RCB | - | RDM | C12 H15 N O3 | CC(=O)N[C@.... |
143 | 5RC6 | - | RBJ | C8 H11 N O | CNCc1ccc(c.... |
144 | 5RBQ | - | R8P | C8 H9 N O3 | C[C@@H](c1.... |
145 | 5R1V | - | R8S | C5 H8 N4 O | COc1ccnc(n.... |
146 | 5R1Z | - | R9M | C6 H7 N O2 S | c1csc(n1)C.... |
147 | 5R2B | - | RDY | C12 H15 N O4 | C[C@@H](C(.... |
148 | 5RC7 | - | AES | C8 H10 F N O2 S | c1cc(ccc1C.... |
149 | 5RBO | - | R8A | C6 H8 N2 O | c1cc(c(nc1.... |
150 | 5R26 | - | RCV | C10 H13 N O3 | COC(=O)COc.... |
151 | 5R1Y | - | R9J | C11 H15 N O2 | Cc1ccc(cc1.... |
152 | 5RBZ | - | R9S | C9 H11 N O | Cc1ccccc1C.... |
153 | 5R1X | - | RQD | C10 H12 F N O2 | COC(=O)[C@.... |
154 | 5RC8 | - | RCV | C10 H13 N O3 | COC(=O)COc.... |
155 | 5RC9 | - | RD4 | C9 H12 N2 O | [H]/N=C(c1.... |
156 | 5RBY | - | R9M | C6 H7 N O2 S | c1csc(n1)C.... |
157 | 5RCF | - | RE7 | C13 H16 F N3 | C[C@H](c1c.... |
158 | 5R24 | - | RB7 | C11 H16 Br N O2 S | Cc1cc(ccc1.... |
159 | 5R28 | - | RDJ | C9 H15 N3 O2 S | CCNC(=O)CS.... |
160 | 5RBT | - | RA7 | C8 H12 N2 O2 S | c1c(sc(n1).... |
161 | 5RCD | - | RDY | C12 H15 N O4 | C[C@@H](C(.... |
162 | 5RBR | - | R8S | C5 H8 N4 O | COc1ccnc(n.... |
163 | 5R2D | - | REG | C11 H20 N2 O2 | C1CCC(C1)N.... |
164 | 5RC0 | - | R9V | C14 H19 N O | c1ccc(cc1).... |
165 | 5R29 | - | RDM | C12 H15 N O3 | CC(=O)N[C@.... |
166 | 5R1T | - | R8A | C6 H8 N2 O | c1cc(c(nc1.... |
167 | 5R2A | - | RDV | C12 H22 N2 O | C1CCC(C1)C.... |
168 | 5R27 | - | RD4 | C9 H12 N2 O | [H]/N=C(c1.... |
169 | 5RBX | - | R9J | C11 H15 N O2 | Cc1ccc(cc1.... |
170 | 5RC1 | - | R9Y | C11 H16 N2 | CN1CCCc2c1.... |
171 | 5RCA | - | RDJ | C9 H15 N3 O2 S | CCNC(=O)CS.... |
172 | 5R22 | - | RA7 | C8 H12 N2 O2 S | c1c(sc(n1).... |
173 | 5RC2 | - | R8Y | C10 H13 N O3 S | CCN(CCC(=O.... |
174 | 5RBW | - | R9G | C12 H15 N O2 | COc1cccc(c.... |
175 | 5RBP | - | SYG | C9 H13 N O | CC[C@@H](c.... |
176 | 1PPM | Ki = 1600 nM | 0P1 | C29 H40 N3 O9 P | C[C@@H](C(.... |
177 | 2WED | Ki = 0.8 uM | PP6 | C29 H32 N2 O7 P | CC(C)[C@H].... |
178 | 1APU | Ki = 1.6 nM | IVA VAL VAL 32L | n/a | n/a |
179 | 2WEC | Ki = 110 uM | PP5 | C28 H32 N2 O7 P | CC(C)[C@@H.... |
180 | 1APW | Ki = 10 nM | IVA VAL VAL DFI NME | n/a | n/a |
181 | 1PPL | Ki = 2.8 nM | 1Z7 | C30 H50 N3 O8 P | CC(C)C[C@H.... |
182 | 2WEB | Ki = 7.6 uM | PP4 | C28 H32 N2 O7 P | CC(C)[C@@H.... |
183 | 2WEA | - | PP6 | C29 H32 N2 O7 P | CC(C)[C@H].... |
184 | 1BXO | Ki = 0.1 nM | PP7 | C30 H47 N4 O9 P | CC(C)C[C@@.... |
185 | 1APT | - | IVA VAL VAL LTA | n/a | n/a |
186 | 1PPK | Ki = 22 nM | IVV | C24 H46 N3 O7 P | CCOC(=O)C[.... |
187 | 1BXQ | Ki = 42 nM | PP8 | C29 H47 N4 O9 P | CC(C)C[C@H.... |
188 | 1APV | Ki = 1 nM | IVA VAL VAL DFO NME | n/a | n/a |
189 | 1SMR | - | PIV HIS PRO PHE HIS LPL TYR TYR SER | n/a | n/a |
190 | 1QRP | - | HH0 | C36 H60 N5 O10 P | C[C@@H](C(.... |
191 | 1PSO | - | IVA VAL VAL STA ALA STA | n/a | n/a |
192 | 2QZX | ic50 = 6 nM | IVA VAL VAL STA ALA STA | n/a | n/a |
193 | 2JXR | Ki = 90 nM | 2Z3 | C32 H49 F2 N5 O7 | NULL |
194 | 1FQ5 | Ki = 4 nM | 0GM | C51 H61 N5 O6 | CC(C)C[C@H.... |
195 | 1QS8 | - | IVA VAL VAL STA ALA STA | n/a | n/a |
196 | 1ZAP | Ki = 0.17 nM | A70 | C42 H70 N6 O5 | CCCC[C@@H].... |
197 | 1IZE | - | IVA VAL VAL STA ALA STA | n/a | n/a |
198 | 1WKR | - | IVA VAL VAL STA ALA STA | n/a | n/a |
199 | 5N7Q | - | IVA VAL VAL STA ALA STA | n/a | n/a |
200 | 5N70 | Kd ~ 3 nM | ALA PHE ARG ILE PRO LEU THR ARG | n/a | n/a |
201 | 3EMY | - | IVA VAL VAL STA ALA STA | n/a | n/a |
202 | 2H6T | Ki = 60 nM | IVA VAL VAL STA ALA STA | n/a | n/a |
203 | 3FV3 | Ki = 0.3 nM | IVA VAL VAL STA ALA STA | n/a | n/a |
204 | 3QVI | - | K95 | C37 H44 N4 O6 S2 | CC1([C@H](.... |
205 | 3APR | - | DHI PRO PHE HIS PUK VAL TYR | n/a | n/a |
206 | 6APR | Ki < 17 nM | IVA VAL VAL STA ALA STA | n/a | n/a |
207 | 5APR | Ki < 17 nM | HIS PRO PHE CYS STA LEU PHE DHL | n/a | n/a |
208 | 4APR | Ki = 200 nM | IVA HIS PRO PHE HIS STA LEU PHE | n/a | n/a |
209 | 1CZI | - | PRO PHI SMC NOR | n/a | n/a |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | F91 | 1 | 1 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | C0V | 0.9573 |
2 | SCE | 0.9568 |
3 | BXS | 0.9541 |
4 | M62 | 0.9458 |
5 | 00G | 0.9447 |
6 | 0RU | 0.9421 |
7 | 0OM | 0.9414 |
8 | EMU | 0.9409 |
9 | ZW2 | 0.9389 |
10 | N08 | 0.9386 |
11 | 5R9 | 0.9371 |
12 | HPX | 0.9368 |
13 | L12 | 0.9347 |
14 | CWP | 0.9346 |
15 | HCC | 0.9343 |
16 | 2L1 | 0.9336 |
17 | 4P9 | 0.9335 |
18 | MQS | 0.9332 |
19 | G8V | 0.9328 |
20 | BZM | 0.9327 |
21 | O2Q | 0.9312 |
22 | 1OX | 0.9299 |
23 | DE7 | 0.9299 |
24 | OX3 | 0.9297 |
25 | RKY | 0.9293 |
26 | 9JH | 0.9290 |
27 | EXP | 0.9282 |
28 | 4VC | 0.9280 |
29 | 35K | 0.9275 |
30 | 4KN | 0.9274 |
31 | HA6 | 0.9272 |
32 | WDT | 0.9272 |
33 | LJ2 | 0.9258 |
34 | 9RK | 0.9253 |
35 | 1UA | 0.9246 |
36 | DX6 | 0.9238 |
37 | JE7 | 0.9235 |
38 | EX7 | 0.9219 |
39 | F5N | 0.9213 |
40 | 2L2 | 0.9207 |
41 | H0V | 0.9206 |
42 | 5ER | 0.9201 |
43 | 9ME | 0.9198 |
44 | 5EZ | 0.9197 |
45 | EBB | 0.9196 |
46 | IXG | 0.9189 |
47 | B4L | 0.9182 |
48 | A06 | 0.9180 |
49 | GJG | 0.9167 |
50 | RK4 | 0.9165 |
51 | JCQ | 0.9165 |
52 | QTV | 0.9162 |
53 | QTK | 0.9158 |
54 | 41L | 0.9154 |
55 | LVB | 0.9153 |
56 | IW5 | 0.9152 |
57 | QS4 | 0.9151 |
58 | 4JW | 0.9151 |
59 | OAG | 0.9151 |
60 | MQR | 0.9146 |
61 | EUB | 0.9140 |
62 | BC3 | 0.9134 |
63 | QDR | 0.9132 |
64 | R7T | 0.9129 |
65 | 0QX | 0.9128 |
66 | 536 | 0.9127 |
67 | 6IP | 0.9126 |
68 | IPJ | 0.9122 |
69 | H35 | 0.9117 |
70 | 49G | 0.9111 |
71 | 0QV | 0.9110 |
72 | HWH | 0.9107 |
73 | 4RG | 0.9105 |
74 | 62P | 0.9104 |
75 | HPK | 0.9102 |
76 | 9F5 | 0.9094 |
77 | 4ZW | 0.9090 |
78 | FQY | 0.9085 |
79 | 7PS | 0.9085 |
80 | BDE | 0.9084 |
81 | JF5 | 0.9083 |
82 | 6XC | 0.9081 |
83 | GJW | 0.9081 |
84 | 7SB | 0.9077 |
85 | CX5 | 0.9076 |
86 | JVB | 0.9075 |
87 | 658 | 0.9067 |
88 | 4VT | 0.9067 |
89 | LJ1 | 0.9067 |
90 | BGK | 0.9064 |
91 | 246 | 0.9062 |
92 | D9Q | 0.9062 |
93 | 5O5 | 0.9061 |
94 | YIH | 0.9061 |
95 | TEF | 0.9058 |
96 | 5HG | 0.9054 |
97 | CW6 | 0.9049 |
98 | K97 | 0.9047 |
99 | CHJ | 0.9047 |
100 | QTJ | 0.9046 |
101 | ZEA | 0.9043 |
102 | ESJ | 0.9041 |
103 | JGY | 0.9038 |
104 | VJJ | 0.9038 |
105 | D5F | 0.9036 |
106 | 4YE | 0.9033 |
107 | BFS | 0.9031 |
108 | IAG | 0.9030 |
109 | IW3 | 0.9028 |
110 | C4F | 0.9025 |
111 | 1PB | 0.9020 |
112 | 6C5 | 0.9019 |
113 | PV1 | 0.9019 |
114 | QNI | 0.9018 |
115 | TCT | 0.9018 |
116 | 5RX | 0.9018 |
117 | LI4 | 0.9016 |
118 | 6Q9 | 0.9015 |
119 | RNK | 0.9013 |
120 | 0OP | 0.9012 |
121 | STL | 0.9008 |
122 | V15 | 0.9008 |
123 | 1CE | 0.9005 |
124 | QTS | 0.9004 |
125 | CMG | 0.9001 |
126 | 7WD | 0.9000 |
127 | AEY | 0.8998 |
128 | F41 | 0.8996 |
129 | WA2 | 0.8996 |
130 | 1HR | 0.8995 |
131 | 5RU | 0.8993 |
132 | WG8 | 0.8993 |
133 | IW4 | 0.8993 |
134 | 0QR | 0.8990 |
135 | QID | 0.8989 |
136 | STS | 0.8988 |
137 | 9MK | 0.8988 |
138 | EXG | 0.8985 |
139 | 1Q2 | 0.8985 |
140 | L02 | 0.8985 |
141 | MH5 | 0.8984 |
142 | PV2 | 0.8983 |
143 | 12R | 0.8982 |
144 | 3IB | 0.8981 |
145 | CT0 | 0.8979 |
146 | JVD | 0.8979 |
147 | PB2 | 0.8974 |
148 | P9L | 0.8973 |
149 | 4PG | 0.8970 |
150 | ENY | 0.8969 |
151 | ON1 | 0.8968 |
152 | Q9P | 0.8967 |
153 | D9T | 0.8966 |
154 | BUN | 0.8964 |
155 | BP5 | 0.8964 |
156 | LI7 | 0.8962 |
157 | 0QA | 0.8961 |
158 | 1Q4 | 0.8959 |
159 | WCU | 0.8957 |
160 | 2JP | 0.8956 |
161 | 4Z0 | 0.8954 |
162 | PV8 | 0.8953 |
163 | JOT | 0.8949 |
164 | 3G3 | 0.8949 |
165 | 100 | 0.8948 |
166 | 5TO | 0.8948 |
167 | NFZ | 0.8944 |
168 | C0E | 0.8942 |
169 | EUK | 0.8939 |
170 | A9E | 0.8939 |
171 | QRP | 0.8938 |
172 | 1Q1 | 0.8937 |
173 | D4G | 0.8932 |
174 | 7XX | 0.8931 |
175 | SZA | 0.8931 |
176 | IPL | 0.8930 |
177 | TPM | 0.8929 |
178 | S0B | 0.8928 |
179 | QTD | 0.8924 |
180 | 1CM | 0.8919 |
181 | FZ3 | 0.8916 |
182 | C1E | 0.8915 |
183 | C0Y | 0.8914 |
184 | PQD | 0.8913 |
185 | DBE | 0.8913 |
186 | RE4 | 0.8912 |
187 | PW8 | 0.8906 |
188 | ML1 | 0.8905 |
189 | IEE | 0.8904 |
190 | WDW | 0.8899 |
191 | QEI | 0.8895 |
192 | AX5 | 0.8895 |
193 | LVP | 0.8891 |
194 | S8P | 0.8889 |
195 | BVB | 0.8887 |
196 | 4WA | 0.8885 |
197 | SFY | 0.8883 |
198 | RO3 | 0.8881 |
199 | B5A | 0.8880 |
200 | RDV | 0.8876 |
201 | RO8 | 0.8875 |
202 | KU1 | 0.8875 |
203 | DCN | 0.8874 |
204 | A8K | 0.8873 |
205 | EYA | 0.8872 |
206 | U73 | 0.8869 |
207 | TCW | 0.8868 |
208 | OJD | 0.8867 |
209 | NAL | 0.8867 |
210 | 5F7 | 0.8865 |
211 | 9VQ | 0.8865 |
212 | NKI | 0.8865 |
213 | FTK | 0.8864 |
214 | CHV | 0.8864 |
215 | 4YF | 0.8863 |
216 | LJV | 0.8862 |
217 | CUQ | 0.8862 |
218 | HPZ | 0.8856 |
219 | Q5M | 0.8856 |
220 | 6BC | 0.8855 |
221 | 3AK | 0.8853 |
222 | D8W | 0.8849 |
223 | EYM | 0.8848 |
224 | 21X | 0.8846 |
225 | STV | 0.8844 |
226 | UN4 | 0.8841 |
227 | JON | 0.8841 |
228 | 5M2 | 0.8840 |
229 | NRG | 0.8837 |
230 | 4JV | 0.8836 |
231 | EFT | 0.8835 |
232 | EYY | 0.8834 |
233 | JBB | 0.8832 |
234 | KTM | 0.8832 |
235 | 0XR | 0.8832 |
236 | M25 | 0.8830 |
237 | 22T | 0.8829 |
238 | OA5 | 0.8828 |
239 | JP8 | 0.8828 |
240 | TQT | 0.8827 |
241 | 4HG | 0.8826 |
242 | TQ3 | 0.8826 |
243 | VIB | 0.8825 |
244 | 2OH | 0.8823 |
245 | 11X | 0.8821 |
246 | XZ1 | 0.8821 |
247 | BXB | 0.8821 |
248 | CMZ | 0.8818 |
249 | HDI | 0.8813 |
250 | Q2S | 0.8811 |
251 | KWV | 0.8809 |
252 | 1V6 | 0.8808 |
253 | NZ4 | 0.8808 |
254 | YKN | 0.8808 |
255 | 69K | 0.8807 |
256 | FIP | 0.8805 |
257 | 9M9 | 0.8805 |
258 | RPN | 0.8801 |
259 | TQL | 0.8801 |
260 | 38D | 0.8798 |
261 | RE2 | 0.8798 |
262 | B7U | 0.8797 |
263 | GB1 | 0.8796 |
264 | NAR | 0.8796 |
265 | A0R | 0.8795 |
266 | 28C | 0.8794 |
267 | 7ZO | 0.8793 |
268 | HHV | 0.8791 |
269 | 3NM | 0.8789 |
270 | UN9 | 0.8786 |
271 | DIH | 0.8786 |
272 | GNR | 0.8785 |
273 | KYN | 0.8784 |
274 | 4MP | 0.8784 |
275 | T34 | 0.8782 |
276 | 30A | 0.8781 |
277 | AX8 | 0.8781 |
278 | PMM | 0.8781 |
279 | C4E | 0.8780 |
280 | FVY | 0.8780 |
281 | 848 | 0.8776 |
282 | 2BI | 0.8775 |
283 | ZIP | 0.8775 |
284 | CMP | 0.8773 |
285 | ALJ | 0.8772 |
286 | 5V3 | 0.8772 |
287 | GB7 | 0.8772 |
288 | EEK | 0.8771 |
289 | 0SL | 0.8770 |
290 | KPV | 0.8770 |
291 | X2L | 0.8768 |
292 | 68Y | 0.8766 |
293 | G30 | 0.8765 |
294 | R4E | 0.8760 |
295 | 43J | 0.8759 |
296 | NXB | 0.8757 |
297 | 6NF | 0.8757 |
298 | 4P8 | 0.8755 |
299 | 6U5 | 0.8754 |
300 | TQ4 | 0.8753 |
301 | QRN | 0.8753 |
302 | BTN | 0.8752 |
303 | G27 | 0.8752 |
304 | ITW | 0.8751 |
305 | 3IP | 0.8750 |
306 | 4EU | 0.8750 |
307 | C09 | 0.8749 |
308 | D80 | 0.8747 |
309 | JA3 | 0.8745 |
310 | H8B | 0.8742 |
311 | C17 | 0.8741 |
312 | HPF | 0.8740 |
313 | 6EO | 0.8740 |
314 | M5A | 0.8740 |
315 | A9B | 0.8738 |
316 | M1D | 0.8738 |
317 | 15I | 0.8737 |
318 | 109 | 0.8736 |
319 | AX6 | 0.8736 |
320 | F0C | 0.8735 |
321 | FT1 | 0.8734 |
322 | RNP | 0.8734 |
323 | 5R8 | 0.8732 |
324 | GUJ | 0.8732 |
325 | 49Z | 0.8731 |
326 | 7BW | 0.8731 |
327 | IDE | 0.8730 |
328 | GB2 | 0.8730 |
329 | HH7 | 0.8727 |
330 | BSA | 0.8725 |
331 | EWT | 0.8723 |
332 | KMG | 0.8722 |
333 | I2E | 0.8719 |
334 | 14X | 0.8717 |
335 | HLP | 0.8717 |
336 | LVY | 0.8716 |
337 | IGP | 0.8715 |
338 | JXQ | 0.8714 |
339 | 22F | 0.8713 |
340 | H48 | 0.8713 |
341 | 87F | 0.8712 |
342 | 9X0 | 0.8711 |
343 | S1D | 0.8710 |
344 | 1OQ | 0.8710 |
345 | 0H9 | 0.8710 |
346 | 5VU | 0.8709 |
347 | 2J5 | 0.8707 |
348 | IJ4 | 0.8707 |
349 | 9W7 | 0.8705 |
350 | JP5 | 0.8705 |
351 | KUP | 0.8703 |
352 | W1G | 0.8703 |
353 | 0SZ | 0.8699 |
354 | EYJ | 0.8692 |
355 | RP1 | 0.8692 |
356 | FNT | 0.8691 |
357 | GHQ | 0.8690 |
358 | 8MF | 0.8690 |
359 | N9M | 0.8690 |
360 | 9N2 | 0.8687 |
361 | Q86 | 0.8683 |
362 | P1Y | 0.8682 |
363 | 7VY | 0.8682 |
364 | 9E3 | 0.8680 |
365 | TRP | 0.8680 |
366 | 6XR | 0.8679 |
367 | M29 | 0.8678 |
368 | SIJ | 0.8677 |
369 | 0OO | 0.8676 |
370 | KHP | 0.8675 |
371 | CUH | 0.8675 |
372 | JPB | 0.8674 |
373 | 0HY | 0.8674 |
374 | XG1 | 0.8672 |
375 | A21 | 0.8671 |
376 | OGY | 0.8670 |
377 | JSX | 0.8669 |
378 | NEU | 0.8669 |
379 | IAV | 0.8666 |
380 | 0OY | 0.8665 |
381 | 531 | 0.8664 |
382 | 9PP | 0.8664 |
383 | UMP | 0.8662 |
384 | 4BE | 0.8660 |
385 | DYZ | 0.8660 |
386 | 3WK | 0.8660 |
387 | 8Y7 | 0.8659 |
388 | A4V | 0.8658 |
389 | S0F | 0.8657 |
390 | XYP XIM | 0.8657 |
391 | HJ1 | 0.8656 |
392 | LIT | 0.8653 |
393 | 5OU | 0.8651 |
394 | AP6 | 0.8650 |
395 | HAN | 0.8650 |
396 | LJ4 | 0.8648 |
397 | AX4 | 0.8644 |
398 | GZT | 0.8644 |
399 | MGI | 0.8644 |
400 | 96Z | 0.8643 |
401 | FUL PK6 | 0.8638 |
402 | YX0 | 0.8638 |
403 | 3D1 | 0.8630 |
404 | M77 | 0.8629 |
405 | 22J | 0.8628 |
406 | 9F8 | 0.8627 |
407 | NIU | 0.8627 |
408 | 5V0 | 0.8626 |
409 | MDR | 0.8625 |
410 | JV5 | 0.8625 |
411 | CHQ | 0.8622 |
412 | 3RC | 0.8617 |
413 | I22 | 0.8614 |
414 | 873 | 0.8614 |
415 | E90 | 0.8612 |
416 | FYJ | 0.8612 |
417 | 2BE | 0.8612 |
418 | 51P | 0.8609 |
419 | GYZ | 0.8609 |
420 | IO2 | 0.8608 |
421 | F63 | 0.8604 |
422 | 1ER | 0.8603 |
423 | 5AV | 0.8603 |
424 | L8N | 0.8602 |
425 | E9P | 0.8597 |
426 | FCW | 0.8596 |
427 | D2S | 0.8594 |
428 | PE2 | 0.8591 |
429 | XDI | 0.8587 |
430 | V50 | 0.8583 |
431 | 27M | 0.8581 |
432 | AZY | 0.8581 |
433 | 856 | 0.8579 |
434 | 7HV | 0.8578 |
435 | 5WK | 0.8578 |
436 | GB6 | 0.8574 |
437 | 10H | 0.8570 |
438 | FZB | 0.8569 |
439 | S0I | 0.8567 |
440 | XDM | 0.8565 |
441 | PZB | 0.8564 |
442 | 7CH | 0.8562 |
443 | OZM | 0.8561 |
444 | BTQ | 0.8558 |
445 | XDH | 0.8555 |
446 | T07 | 0.8553 |
447 | C6Z | 0.8551 |
448 | FT3 | 0.8551 |
449 | 6SW | 0.8549 |
450 | 4VR | 0.8545 |
451 | FT2 | 0.8540 |
452 | 8YH | 0.8539 |
453 | EP1 | 0.8539 |
454 | 5MX | 0.8535 |
455 | UAY | 0.8532 |
456 | OYS | 0.8509 |
This union binding pocket(no: 1) in the query (biounit: 4er2.bio1) has 39 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 1J71 | THR ILE THR SER | 42.4242 |