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No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 26 families. | |||||
1 | 1MT6 | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
2 | 1N6C | - | SAM | C15 H22 N6 O5 S | C[S@@+](CC.... |
3 | 3VUZ | - | K15 | C20 H33 N7 O5 | CCCCCCN(CC.... |
4 | 3VV0 | - | KH3 | C22 H38 N8 O5 | CCCCCCNCCN.... |
5 | 3CBO | - | ILE LYS ARG SER MLZ LYS ASN SER LEU ALA | n/a | n/a |
6 | 3CBP | - | ILE LYS ARG SER LYS LYS ASN SER LEU ALA | n/a | n/a |
7 | 5EG2 | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
8 | 3OS5 | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
9 | 1XQH | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
10 | 1N6A | - | SAM | C15 H22 N6 O5 S | C[S@@+](CC.... |
11 | 1O9S | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
12 | 5YLT | ic50 = 0.41 uM | C7N | C21 H21 N O | CN1CCC(=C2.... |
13 | 5AYF | Ki = 15 uM | C7H | C21 H21 N | CN1CCC(=C2.... |
14 | 3CBM | - | ILE LYS ARG SER MLZ LYS ASN SER LEU ALA | n/a | n/a |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 21 families. | |||||
1 | 1MT6 | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
2 | 1N6C | - | SAM | C15 H22 N6 O5 S | C[S@@+](CC.... |
3 | 3VUZ | - | K15 | C20 H33 N7 O5 | CCCCCCN(CC.... |
4 | 3VV0 | - | KH3 | C22 H38 N8 O5 | CCCCCCNCCN.... |
5 | 3CBO | - | ILE LYS ARG SER MLZ LYS ASN SER LEU ALA | n/a | n/a |
6 | 3CBP | - | ILE LYS ARG SER LYS LYS ASN SER LEU ALA | n/a | n/a |
7 | 5EG2 | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
8 | 3OS5 | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
9 | 1XQH | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
10 | 1N6A | - | SAM | C15 H22 N6 O5 S | C[S@@+](CC.... |
11 | 1O9S | - | SAH | C14 H20 N6 O5 S | c1nc(c2c(n.... |
12 | 5YLT | ic50 = 0.41 uM | C7N | C21 H21 N O | CN1CCC(=C2.... |
13 | 5AYF | Ki = 15 uM | C7H | C21 H21 N | CN1CCC(=C2.... |
14 | 3CBM | - | ILE LYS ARG SER MLZ LYS ASN SER LEU ALA | n/a | n/a |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | KH3 | 1 | 1 |
2 | K15 | 0.791667 | 0.986486 |
3 | KYE | 0.695238 | 0.873418 |
4 | 62X | 0.693069 | 0.935065 |
5 | HZ2 | 0.663636 | 0.896104 |
6 | KXW | 0.654545 | 0.92 |
7 | HY8 | 0.637168 | 0.896104 |
8 | SA8 | 0.61 | 0.92 |
9 | KB1 | 0.605505 | 0.835443 |
10 | OZP | 0.6 | 0.894737 |
11 | F0P | 0.545455 | 0.894737 |
12 | Q34 | 0.545455 | 0.82716 |
13 | Q2M | 0.532787 | 0.848101 |
14 | 0UM | 0.531532 | 0.959459 |
15 | KYB | 0.531532 | 0.848101 |
16 | KY2 | 0.527273 | 0.848101 |
17 | S7M | 0.522936 | 0.896104 |
18 | Q2V | 0.52 | 0.883117 |
19 | SFG | 0.514286 | 0.851351 |
20 | SAI | 0.514019 | 0.855263 |
21 | KY5 | 0.508621 | 0.893333 |
22 | Q2P | 0.507812 | 0.82716 |
23 | EEM | 0.504587 | 0.871795 |
24 | KY8 | 0.504348 | 0.87013 |
25 | SAH | 0.5 | 0.866667 |
26 | EP4 | 0.5 | 0.805195 |
27 | MHZ | 0.490566 | 0.898734 |
28 | 5X8 | 0.485981 | 0.84 |
29 | GJV | 0.466667 | 0.8 |
30 | 6RE | 0.466019 | 0.7875 |
31 | MAO | 0.462264 | 0.807229 |
32 | MYR AMP | 0.458333 | 0.821429 |
33 | J7C | 0.457143 | 0.797468 |
34 | SAM | 0.455357 | 0.871795 |
35 | KAA | 0.453782 | 0.702128 |
36 | 5CD | 0.453608 | 0.763158 |
37 | ADN | 0.452632 | 0.776316 |
38 | RAB | 0.452632 | 0.776316 |
39 | XYA | 0.452632 | 0.776316 |
40 | 3DH | 0.45098 | 0.826667 |
41 | SXZ | 0.45 | 0.871795 |
42 | 1ZZ | 0.45 | 0.821429 |
43 | YLB | 0.449612 | 0.845238 |
44 | YLP | 0.448819 | 0.845238 |
45 | A5A | 0.447368 | 0.638298 |
46 | 5SV | 0.444444 | 0.807229 |
47 | SMM | 0.443478 | 0.8625 |
48 | SSA | 0.443478 | 0.652632 |
49 | 5N5 | 0.443299 | 0.8 |
50 | LAD | 0.441667 | 0.797619 |
51 | A4D | 0.438776 | 0.776316 |
52 | 5AL | 0.438596 | 0.72619 |
53 | YLC | 0.438462 | 0.8 |
54 | NVA LMS | 0.436975 | 0.684211 |
55 | AYB | 0.43609 | 0.835294 |
56 | M2T | 0.435644 | 0.7625 |
57 | DTA | 0.435644 | 0.746835 |
58 | XAH | 0.435484 | 0.758621 |
59 | F2R | 0.432836 | 0.741573 |
60 | KG4 | 0.432432 | 0.697674 |
61 | MTA | 0.431373 | 0.802632 |
62 | 5AS | 0.431193 | 0.670213 |
63 | GSU | 0.429752 | 0.670213 |
64 | ZAS | 0.428571 | 0.75 |
65 | DSZ | 0.428571 | 0.652632 |
66 | LSS | 0.428571 | 0.65625 |
67 | VMS | 0.42735 | 0.625 |
68 | 54H | 0.42735 | 0.625 |
69 | A3S | 0.427273 | 0.815789 |
70 | V2G | 0.426087 | 0.744186 |
71 | S4M | 0.425926 | 0.910256 |
72 | AMP MG | 0.424528 | 0.698795 |
73 | 53H | 0.423729 | 0.618557 |
74 | QA7 | 0.423729 | 0.72093 |
75 | 5CA | 0.423729 | 0.652632 |
76 | TSB | 0.423729 | 0.631579 |
77 | CA0 | 0.423423 | 0.697674 |
78 | EU9 | 0.423077 | 0.730337 |
79 | VRT | 0.421053 | 0.868421 |
80 | NEC | 0.420561 | 0.8 |
81 | DSH | 0.420561 | 0.893333 |
82 | GEK | 0.420168 | 0.833333 |
83 | N37 | 0.419847 | 0.807692 |
84 | OMR | 0.419847 | 0.811765 |
85 | A3T | 0.419643 | 0.802632 |
86 | 8LH | 0.418803 | 0.75 |
87 | V47 | 0.418803 | 0.789474 |
88 | SRP | 0.418803 | 0.75 |
89 | WAQ | 0.418033 | 0.77381 |
90 | ABM | 0.416667 | 0.714286 |
91 | AMO | 0.416667 | 0.729412 |
92 | 45A | 0.416667 | 0.714286 |
93 | A3N | 0.416667 | 0.792208 |
94 | PRX | 0.415929 | 0.759036 |
95 | U4Y | 0.415385 | 0.833333 |
96 | 52H | 0.415254 | 0.618557 |
97 | AMP | 0.415094 | 0.690476 |
98 | LMS | 0.415094 | 0.617021 |
99 | A | 0.415094 | 0.690476 |
100 | ME8 | 0.414634 | 0.77907 |
101 | TXA | 0.414634 | 0.709302 |
102 | SON | 0.414414 | 0.729412 |
103 | ARG AMP | 0.414062 | 0.75 |
104 | 7MD | 0.414062 | 0.77907 |
105 | AHX | 0.413223 | 0.704545 |
106 | NWW | 0.41 | 0.72 |
107 | LEU LMS | 0.409836 | 0.680851 |
108 | BA3 | 0.409091 | 0.674419 |
109 | G5A | 0.408696 | 0.670213 |
110 | 9ZA | 0.408333 | 0.693182 |
111 | 8QN | 0.408333 | 0.72619 |
112 | 9ZD | 0.408333 | 0.693182 |
113 | YLA | 0.407407 | 0.781609 |
114 | AOC | 0.407407 | 0.75641 |
115 | A3G | 0.407407 | 0.828947 |
116 | ATP | 0.40708 | 0.674419 |
117 | HEJ | 0.40708 | 0.674419 |
118 | J4G | 0.406504 | 0.741176 |
119 | B4P | 0.405405 | 0.674419 |
120 | AP5 | 0.405405 | 0.674419 |
121 | NSS | 0.404959 | 0.635417 |
122 | A2D | 0.40367 | 0.674419 |
123 | 0XU | 0.403509 | 0.802632 |
124 | 5FA | 0.403509 | 0.674419 |
125 | AQP | 0.403509 | 0.674419 |
126 | NB8 | 0.403226 | 0.704545 |
127 | AN2 | 0.401786 | 0.666667 |
128 | A7D | 0.401786 | 0.828947 |
129 | 8LE | 0.401709 | 0.701149 |
130 | K2H | 0.401639 | 0.78481 |
131 | DAL AMP | 0.4 | 0.72619 |
132 | 8LQ | 0.4 | 0.75 |
133 | NVA 2AD | 0.4 | 0.857143 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 5ylt.bio1) has 41 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 5ylt.bio1) has 42 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |