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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 28 families. | |||||
1 | 4RMG | ic50 = 0.14 uM | 3TE | C22 H20 N4 O S2 | Cc1cc(nc(n.... |
2 | 4R8M | - | PRO LYS LYS THR GLY 3LX | n/a | n/a |
3 | 4RMH | - | 3TE | C22 H20 N4 O S2 | Cc1cc(nc(n.... |
4 | 5DY4 | ic50 = 0.21 uM | 5GN | C22 H19 Br N4 O S2 | Cc1cc(nc(n.... |
5 | 4Y6L | - | THR ALA ARG MYK SER THR GLY | n/a | n/a |
6 | 5MAR | ic50 = 41.2 uM | 7KE | C11 H11 Cl N2 O2 | c1cc(ccc1c.... |
7 | 3ZGV | - | AR6 | C15 H23 N5 O14 P2 | c1nc(c2c(n.... |
8 | 4Y6O | - | LEU PRO LYS MYK THR GLY GLY | n/a | n/a |
9 | 4RMJ | - | NCA | C6 H6 N2 O | c1cc(cnc1).... |
10 | 5DY5 | ic50 = 0.118 uM | 5GR | C28 H27 N7 O2 S2 | Cc1cc(nc(n.... |
11 | 5D7P | ic50 = 20 uM | OCZ | C13 H13 Cl N2 O | c1cc2c(cc1.... |
12 | 4RMI | - | 3TK | C18 H18 N4 O S2 | Cc1cc(nc(n.... |
13 | 5Y0Z | ic50 = 0.46 uM | 8K9 | C30 H44 N2 O3 | CCC(C)(C)c.... |
14 | 5YQN | ic50 = 93.7 uM | L55 | C26 H26 N6 O3 S | Cc1cc(nc(n.... |
15 | 5MAT | ic50 = 0.58 uM | 7KJ | C28 H28 N4 O3 S | Cc1c(c(on1.... |
16 | 4Y6Q | - | OMR | C29 H49 N5 O15 P2 | CCCCCCCCCC.... |
17 | 5D7Q | ic50 = 2.8 uM | 4I5 | C14 H15 Cl N2 O | c1cc2c(cc1.... |
18 | 5YQM | - | A2X | C20 H19 N3 O S2 | Cc1cc(nc(n.... |
19 | 5G4C | Kd = 13.7 uM | ARG ALA ALA 6G4 THR | n/a | n/a |
20 | 5YQL | ic50 = 25.9 uM | A2I | C21 H21 N3 O2 S | Cc1cc(nc(n.... |
21 | 5YQO | ic50 = 0.815 uM | L5C | C26 H26 N6 O3 S | Cc1cc(nc(n.... |
22 | 5D7O | - | AR6 | C15 H23 N5 O14 P2 | c1nc(c2c(n.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 18 families. | |||||
1 | 1SZD | Kd = 29.16 uM | APR | C15 H23 N5 O14 P2 | c1nc(c2c(n.... |
2 | 1Q1A | - | OAD | C17 H25 N5 O15 P2 | CC(=O)O[C@.... |
3 | 1SZC | - | CNA | C22 H30 N7 O13 P2 | c1cc(c[n+].... |
4 | 4RMG | ic50 = 0.14 uM | 3TE | C22 H20 N4 O S2 | Cc1cc(nc(n.... |
5 | 4R8M | - | PRO LYS LYS THR GLY 3LX | n/a | n/a |
6 | 4RMH | - | 3TE | C22 H20 N4 O S2 | Cc1cc(nc(n.... |
7 | 5DY4 | ic50 = 0.21 uM | 5GN | C22 H19 Br N4 O S2 | Cc1cc(nc(n.... |
8 | 4Y6L | - | THR ALA ARG MYK SER THR GLY | n/a | n/a |
9 | 5MAR | ic50 = 41.2 uM | 7KE | C11 H11 Cl N2 O2 | c1cc(ccc1c.... |
10 | 3ZGV | - | AR6 | C15 H23 N5 O14 P2 | c1nc(c2c(n.... |
11 | 4Y6O | - | LEU PRO LYS MYK THR GLY GLY | n/a | n/a |
12 | 4RMJ | - | NCA | C6 H6 N2 O | c1cc(cnc1).... |
13 | 5DY5 | ic50 = 0.118 uM | 5GR | C28 H27 N7 O2 S2 | Cc1cc(nc(n.... |
14 | 5D7P | ic50 = 20 uM | OCZ | C13 H13 Cl N2 O | c1cc2c(cc1.... |
15 | 4RMI | - | 3TK | C18 H18 N4 O S2 | Cc1cc(nc(n.... |
16 | 5Y0Z | ic50 = 0.46 uM | 8K9 | C30 H44 N2 O3 | CCC(C)(C)c.... |
17 | 5YQN | ic50 = 93.7 uM | L55 | C26 H26 N6 O3 S | Cc1cc(nc(n.... |
18 | 5MAT | ic50 = 0.58 uM | 7KJ | C28 H28 N4 O3 S | Cc1c(c(on1.... |
19 | 4Y6Q | - | OMR | C29 H49 N5 O15 P2 | CCCCCCCCCC.... |
20 | 5D7Q | ic50 = 2.8 uM | 4I5 | C14 H15 Cl N2 O | c1cc2c(cc1.... |
21 | 5YQM | - | A2X | C20 H19 N3 O S2 | Cc1cc(nc(n.... |
22 | 5G4C | Kd = 13.7 uM | ARG ALA ALA 6G4 THR | n/a | n/a |
23 | 5YQL | ic50 = 25.9 uM | A2I | C21 H21 N3 O2 S | Cc1cc(nc(n.... |
24 | 5YQO | ic50 = 0.815 uM | L5C | C26 H26 N6 O3 S | Cc1cc(nc(n.... |
25 | 5D7O | - | AR6 | C15 H23 N5 O14 P2 | c1nc(c2c(n.... |
26 | 4FZ3 | - | ACE ARG HIS LYS ALY MCM | n/a | n/a |
27 | 4JT9 | ic50 = 0.0072 uM | 1NS | C15 H21 N5 O3 S2 | CS(=O)(=O).... |
28 | 5BWO | - | PLM GLN THR ALA ARG LYS SER THR GLY GLY TRP | n/a | n/a |
29 | 4JT8 | ic50 = 0.033 uM | 1NR | C19 H27 N5 O2 S | CC(C)(C)C(.... |
30 | 4BV3 | Kd = 16.5 uM | OCZ | C13 H13 Cl N2 O | c1cc2c(cc1.... |
31 | 4BVH | - | OAD | C17 H25 N5 O15 P2 | CC(=O)O[C@.... |
32 | 4C7B | - | ARG HIS LYS FDL | n/a | n/a |
33 | 4C78 | - | BVB | C14 H11 Br O2 | c1cc(ccc1/.... |
34 | 5BWN | - | GLN THR ALA ARG MYK SER THR GLY GLY TRP | n/a | n/a |
35 | 4BN4 | - | AR6 | C15 H23 N5 O14 P2 | c1nc(c2c(n.... |
36 | 4JSR | ic50 = 0.004 uM | 1NQ | C22 H26 N6 O3 S2 | CCNC(=O)c1.... |
37 | 4BVE | - | THR ARG SER GLY FZN VAL MET ARG ARG LEU | n/a | n/a |
38 | 4BVB | - | AR6 | C15 H23 N5 O14 P2 | c1nc(c2c(n.... |
39 | 4FVT | - | CNA | C22 H30 N7 O13 P2 | c1cc(c[n+].... |
40 | 4I5I | - | 4I5 | C14 H15 Cl N2 O | c1cc2c(cc1.... |
This union binding pocket(no: 1) in the query (biounit: 5dy5.bio2) has 61 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 5CHR | 4NC | None |
2 | 5Y02 | HBX | None |
3 | 1UO5 | PIH | None |
4 | 4WG0 | CHD | None |
5 | 5Y02 | MXN | None |
6 | 1UO4 | PIH | None |
7 | 5H6S | HDH | 1.64474 |
8 | 5WA0 | MSS | 1.64474 |
9 | 3GDN | MXN | 1.64474 |
10 | 3B1F | NAD | 1.72414 |
11 | 4XCP | PLM | 1.76471 |
12 | 1RNT | 2GP | 1.92308 |
13 | 4NTO | 1PW | 2.41546 |
14 | 3GU3 | SAH | 2.46479 |
15 | 3K6V | CIT | 2.54237 |
16 | 3NJQ | NJQ | 2.59067 |
17 | 1YBH | FAD | 2.63158 |
18 | 4DMG | SAM | 2.63158 |
19 | 3VSE | SAH | 2.63158 |
20 | 4L2I | FAD | 2.6616 |
21 | 1ZX5 | LFR | 2.66667 |
22 | 6CB2 | OLC | 2.73038 |
23 | 2NXE | SAM | 2.75591 |
24 | 3DAK | ANP | 2.75862 |
25 | 1O9W | NAG | 2.82486 |
26 | 2Q28 | ADP | 2.96053 |
27 | 5W7B | MYR | 2.96053 |
28 | 3L9W | AMP | 2.96053 |
29 | 2OG2 | MLI | 2.96053 |
30 | 2CXG | GLC GLC | 2.96053 |
31 | 3EYA | FAD | 2.96053 |
32 | 3L9W | GSH | 2.96053 |
33 | 1XF1 | CIT | 2.96053 |
34 | 3I9U | DTU | 3.04183 |
35 | 3FS1 | ALA ALA LEU ALA ALA LEU LEU ALA ALA | 3.04348 |
36 | 3ZV6 | NAD | 3.20285 |
37 | 5KVA | SAM | 3.23741 |
38 | 2ALG | HP6 | 3.26087 |
39 | 2ALG | DAO | 3.26087 |
40 | 3KLL | MAL | 3.28947 |
41 | 2HZL | PYR | 3.28947 |
42 | 1YKD | CMP | 3.28947 |
43 | 3EGI | ADP | 3.39806 |
44 | 4DE3 | DN8 | 3.42205 |
45 | 6AYH | C3G | 3.48259 |
46 | 3VYW | SAM | 3.57143 |
47 | 4URG | C2E | 3.59281 |
48 | 5OSW | DIU | 3.61842 |
49 | 3G58 | 988 | 3.61842 |
50 | 4EJN | 0R4 | 3.61842 |
51 | 3G4G | D71 | 3.61842 |
52 | 1R6N | 434 | 3.79147 |
53 | 2FKA | BEF | 3.87597 |
54 | 4QO5 | NAG | 3.94737 |
55 | 4Z2B | 4LC | 3.94737 |
56 | 5JE8 | NAD | 3.94737 |
57 | 1YXM | ADE | 3.9604 |
58 | 5AZC | PGT | 4 |
59 | 1UAY | ADN | 4.13223 |
60 | 4P3H | 25G | 4.14508 |
61 | 5OCQ | CIT | 4.21053 |
62 | 5GVR | LMR | 4.2735 |
63 | 1TZJ | A3B | 4.27632 |
64 | 1HFU | NAG NDG | 4.27632 |
65 | 5X7Q | GLC GLC GLC | 4.27632 |
66 | 5X7Q | GLC GLC GLC GLC | 4.27632 |
67 | 3FSY | SCA | 4.27632 |
68 | 3GWZ | SAH | 4.27632 |
69 | 3GXO | SAH | 4.27632 |
70 | 1QXA | GLY GLY GLY | 4.27632 |
71 | 3ABI | NAD | 4.27632 |
72 | 5WKC | FAD | 4.60526 |
73 | 1T9D | FAD | 4.60526 |
74 | 4K91 | SIN | 4.60526 |
75 | 2AF6 | BRU | 4.65116 |
76 | 4RHP | PEF | 4.68085 |
77 | 1RDS | GPC | 4.7619 |
78 | 3CF6 | SP1 | 4.79042 |
79 | 2XYQ | SAH | 4.91803 |
80 | 1Q7E | MET | 4.93421 |
81 | 5HCN | DAO | 4.93421 |
82 | 1PJS | NAD | 4.93421 |
83 | 2BHZ | MAL | 4.93421 |
84 | 5N26 | CPT | 4.94506 |
85 | 4NTM | 2K8 | 4.95868 |
86 | 4NTK | ZSP | 4.95868 |
87 | 1PNO | NAP | 5 |
88 | 2OOR | TXP | 5.17241 |
89 | 1J78 | VDY | 5.26316 |
90 | 5YAS | FAC | 5.44747 |
91 | 4FGC | PQ0 | 5.45455 |
92 | 1KYQ | NAD | 5.47445 |
93 | 1SQL | GUN | 5.47945 |
94 | 6AYI | C3G | 5.52764 |
95 | 5CQG | 55C | 5.59211 |
96 | 5H4S | RAM | 5.6338 |
97 | 1L3I | SAH | 5.72917 |
98 | 2XG5 | EC5 | 5.78035 |
99 | 2XG5 | EC2 | 5.78035 |
100 | 1DEK | DGP | 5.80913 |
101 | 4URX | FK1 | 5.92105 |
102 | 6BVM | EBV | 5.92105 |
103 | 6BVK | EAV | 5.92105 |
104 | 6BVI | EC4 | 5.92105 |
105 | 6BVL | EBY | 5.92105 |
106 | 6BVJ | EAS | 5.92105 |
107 | 1O9U | ADZ | 5.92105 |
108 | 6BR8 | 6OU | 5.95238 |
109 | 6BR8 | PGV | 5.95238 |
110 | 3LL5 | IP8 | 6.0241 |
111 | 6CI9 | NAP | 6.17761 |
112 | 4A59 | AMP | 6.25 |
113 | 1G7C | 5GP | 6.25 |
114 | 2PX6 | DH9 | 6.25 |
115 | 4R29 | SAM | 6.25 |
116 | 2JBM | SRT | 6.35452 |
117 | 1JG3 | ADN | 6.38298 |
118 | 5OBY | ANP | 6.57895 |
119 | 1SQF | SAM | 6.57895 |
120 | 2BCG | GER | 6.79612 |
121 | 2PRG | BRL | 6.81818 |
122 | 1DJN | FMN | 6.90789 |
123 | 5O2D | 9HH | 7 |
124 | 2HNK | SAH | 7.11297 |
125 | 3RMK | BML | 7.22892 |
126 | 3DEF | GDP | 7.23684 |
127 | 3FXU | TSU | 7.23684 |
128 | 1ZQ9 | SAM | 7.36842 |
129 | 5E5U | MLT | 7.53769 |
130 | 2WH8 | II2 | 7.56579 |
131 | 4O4Z | N2O | 7.79221 |
132 | 4CQM | NAP | 8.22368 |
133 | 2GWH | PCI | 8.72483 |
134 | 1LSS | NAD | 8.88158 |
135 | 4I4S | LAT | 8.90411 |
136 | 1DJL | NAP | 9.17874 |
137 | 1NBU | PH2 | 9.2437 |
138 | 1NU4 | MLA | 9.27835 |
139 | 2VOH | CIT | 9.55414 |
140 | 5A3B | APR | 9.57096 |
141 | 5LX9 | OLB | 9.85915 |
142 | 2V5E | SCR | 9.90099 |
143 | 5W8X | UDP | 10.1974 |
144 | 1D4O | NAP | 10.3261 |
145 | 4PW9 | MSS | 10.3774 |
146 | 1P77 | ATR | 10.8553 |
147 | 5MWE | TCE | 11.1111 |
148 | 5C1M | CLR | 11.2 |
149 | 3ROE | THM | 11.3208 |
150 | 5KAX | RHQ | 11.4458 |
151 | 1L5J | TRA | 11.5132 |
152 | 4CS9 | AMP | 11.6402 |
153 | 3W9F | I3P | 11.8421 |
154 | 4V1T | ADP | 12.5 |
155 | 5DCH | 1YO | 13.0208 |
156 | 5KK4 | 44E | 14.5833 |
157 | 1N8V | BDD | 17.8571 |
158 | 1DCP | HBI | 18.2692 |
159 | 5Z84 | CHD | 18.6441 |
160 | 5ZCO | CHD | 18.6441 |
161 | 1T0S | BML | 20.9302 |
162 | 3U31 | NAD | 35.5172 |
163 | 1M2K | APR | 39.759 |
This union binding pocket(no: 3) in the query (biounit: 5dy5.bio1) has 64 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |