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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 101 families. | |||||
1 | 5HTB | Kd = 170 nM | ALA ARG LYS LYS GLN THR 66N 6L5 | n/a | n/a |
2 | 6G36 | Kd = 16.3 nM | EKH | C11 H13 Cl N4 O4 | c1c(c2c(nc.... |
3 | 3IQ7 | - | 5ID | C11 H13 I N4 O4 | c1c(c2c(nc.... |
4 | 6G39 | - | 5ID | C11 H13 I N4 O4 | c1c(c2c(nc.... |
5 | 6G37 | Kd = 42.7 nM | FTU | C11 H13 F N4 O4 | c1c(c2c(nc.... |
6 | 5HTC | Kd = 150 nM | ALA ARG LYS LYS GLN THR 66N 66M | n/a | n/a |
7 | 7AVQ | ic50 = 0.064 uM | S1Z | C17 H18 N6 O | CC[C@H](CO.... |
8 | 3DLZ | - | AMP | C10 H14 N5 O7 P | c1nc(c2c(n.... |
9 | 4QTC | Kd = 0.297 uM | 38Z | C33 H33 N9 O2 | c1cnc(nc1).... |
10 | 6G35 | Kd = 17.5 nM | EKK | C11 H13 Br N4 O4 | c1c(c2c(nc.... |
11 | 6G34 | Kd = 5.7 nM | 5ID | C11 H13 I N4 O4 | c1c(c2c(nc.... |
12 | 6G3A | - | 5ID | C11 H13 I N4 O4 | c1c(c2c(nc.... |
13 | 6G38 | Kd = 239.2 nM | TBN | C11 H14 N4 O4 | c1cn(c2c1c.... |
14 | 2VUW | - | 5ID | C11 H13 I N4 O4 | c1c(c2c(nc.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 70 families. | |||||
1 | 5HTB | Kd = 170 nM | ALA ARG LYS LYS GLN THR 66N 6L5 | n/a | n/a |
2 | 6G36 | Kd = 16.3 nM | EKH | C11 H13 Cl N4 O4 | c1c(c2c(nc.... |
3 | 3IQ7 | - | 5ID | C11 H13 I N4 O4 | c1c(c2c(nc.... |
4 | 6G39 | - | 5ID | C11 H13 I N4 O4 | c1c(c2c(nc.... |
5 | 6G37 | Kd = 42.7 nM | FTU | C11 H13 F N4 O4 | c1c(c2c(nc.... |
6 | 5HTC | Kd = 150 nM | ALA ARG LYS LYS GLN THR 66N 66M | n/a | n/a |
7 | 7AVQ | ic50 = 0.064 uM | S1Z | C17 H18 N6 O | CC[C@H](CO.... |
8 | 3DLZ | - | AMP | C10 H14 N5 O7 P | c1nc(c2c(n.... |
9 | 4QTC | Kd = 0.297 uM | 38Z | C33 H33 N9 O2 | c1cnc(nc1).... |
10 | 6G35 | Kd = 17.5 nM | EKK | C11 H13 Br N4 O4 | c1c(c2c(nc.... |
11 | 6G34 | Kd = 5.7 nM | 5ID | C11 H13 I N4 O4 | c1c(c2c(nc.... |
12 | 6G3A | - | 5ID | C11 H13 I N4 O4 | c1c(c2c(nc.... |
13 | 6G38 | Kd = 239.2 nM | TBN | C11 H14 N4 O4 | c1cn(c2c1c.... |
14 | 2VUW | - | 5ID | C11 H13 I N4 O4 | c1c(c2c(nc.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|
No: | Ligand | Similarity coefficient |
---|---|---|
1 | ALA ARG LYS LYS GLN THR 66N 66M | 1.0000 |
This union binding pocket(no: 1) in the query (biounit: 6g34.bio1) has 26 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 4OH4 | ANP | 2.2409 |
2 | 4UX9 | ANP | 4.48179 |
3 | 4CFU | 2WC | 4.62046 |
4 | 4CFU | 2WC | 4.62046 |
5 | 6GUE | FB8 | 4.63576 |
6 | 4BCN | T9N | 4.66667 |
7 | 4BCN | T9N | 4.66667 |
8 | 6FYV | 3NG | 5.63798 |
9 | 3SRV | S19 | 5.77617 |
10 | 3SRV | S19 | 5.77617 |
11 | 6G33 | 5ID | 6.16247 |
12 | 6G33 | 5ID | 6.16247 |
13 | 5X8I | SQZ | 6.16247 |
14 | 5LPB | ADP | 6.75676 |
15 | 2VN9 | GVD | 6.97674 |
16 | 2VN9 | GVD | 6.97674 |
17 | 5LI1 | ANP | 8.96359 |
18 | 1V0O | INR | 9.02778 |
19 | 1U5R | ATP | 9.52381 |
20 | 1U5R | ATP | 9.52381 |
21 | 1UNH | IXM | 10.9589 |
22 | 2ZV2 | 609 | 11.0738 |
23 | 1BYG | STU | 12.0448 |
24 | 2V7O | DRN | 12.7976 |
25 | 1O9U | ADZ | 14.2857 |
26 | 6JKM | ADP | 18.4751 |
27 | 6GU6 | 1QK | 29.6919 |
28 | 5HQ0 | LZ9 | 29.6919 |