Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00275450
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
LNT![]() | N-[(2S)-2-amino-1,1-dihydroxy-4- methylpentyl]-L-threonine | A,B,C | 3B80 | 0.73 | ![]() |
LNT![]() | N-[(2S)-2-amino-1,1-dihydroxy-4- methylpentyl]-L-threonine | A,B,C | 3B7V | 0.73 | ![]() |
CDT![]() | 4-METHYLSULFANYL-2-UREIDO-BUTYRIC ACID | A,B | 1UF5 | 0.75 | ![]() |
CDV![]() | 3-METHYL-2-UREIDO-BUTYRIC ACID | B | 1UF7 | 0.81 | ![]() |
NXA![]() | N-CARBOXYALANINE | A | 2IUX | 0.72 | ![]() |
NXA![]() | N-CARBOXYALANINE | A | 1O8A | 0.72 | ![]() |
DSE![]() | N-METHYL-D-SERINE | C | 1CWH | 0.78 | ![]() |
DTH![]() | D-THREONINE | A | 1KRO | 0.76 | ![]() |
DTH![]() | D-THREONINE | A,B,C,D | 3BOG | 0.76 | ![]() |
DTH![]() | D-THREONINE | A,B | 173D | 0.76 | ![]() |
DTH![]() | D-THREONINE | A | 209D | 0.76 | ![]() |
DTH![]() | D-THREONINE | A | 316D | 0.76 | ![]() |
DTH![]() | D-THREONINE | A,B | 2Q33 | 0.76 | ![]() |
DTH![]() | D-THREONINE | A | 2JUE | 0.76 | ![]() |
DTH![]() | D-THREONINE | A | 2D55 | 0.76 | ![]() |
NCD![]() | N-CARBAMOYL-L-ASPARTATE | A,B | 2Z26 | 0.78 | ![]() |
NCD![]() | N-CARBAMOYL-L-ASPARTATE | A,B | 1J79 | 0.78 | ![]() |
NCD![]() | N-CARBAMOYL-L-ASPARTATE | A,B | 1XGE | 0.78 | ![]() |
NCD![]() | N-CARBAMOYL-L-ASPARTATE | A,B | 2Z29 | 0.78 | ![]() |
NCD![]() | N-CARBAMOYL-L-ASPARTATE | A,B,G,H | 1R0C | 0.78 | ![]() |
NCD![]() | N-CARBAMOYL-L-ASPARTATE | A,B | 2Z27 | 0.78 | ![]() |
NCD![]() | N-CARBAMOYL-L-ASPARTATE | A,B | 2Z28 | 0.78 | ![]() |
NCD![]() | N-CARBAMOYL-L-ASPARTATE | A,B | 2Z2A | 0.78 | ![]() |
NCD![]() | N-CARBAMOYL-L-ASPARTATE | A,B | 2Z24 | 0.78 | ![]() |
NCD![]() | N-CARBAMOYL-L-ASPARTATE | A,B | 2Z25 | 0.78 | ![]() |
AN0![]() | N-ACETYL-L-NORVALINE | C,D,E,X,Y,Z | 2G7M | 0.71 | ![]() |
AN0![]() | N-ACETYL-L-NORVALINE | A | 1ZQ8 | 0.71 | ![]() |
N10![]() | O-[(HEXYLAMINO)CARBONYL]-L-SERINE | A,B,C,D,E,F, G,H | 2Q0S | 0.71 | ![]() |
OLN![]() | (S)-2-ACETAMIDO-5-UREIDOPENTANOIC ACID | A | 1YH1 | 0.73 | ![]() |
AYA![]() | N-ACETYLALANINE | A | 1D0W | 0.7 | ![]() |
AYA![]() | N-ACETYLALANINE | A | 1AH4 | 0.7 | ![]() |
AYA![]() | N-ACETYLALANINE | A,B | 1VBP | 0.7 | ![]() |
AYA![]() | N-ACETYLALANINE | A,B,C,D,E,F, G,H | 1J4T | 0.7 | ![]() |
AYA![]() | N-ACETYLALANINE | A,B,C,D | 1OUW | 0.7 | ![]() |
AYA![]() | N-ACETYLALANINE | A | 1AH3 | 0.7 | ![]() |
AYA![]() | N-ACETYLALANINE | A | 1EKO | 0.7 | ![]() |
AYA![]() | N-ACETYLALANINE | B,D,F,H | 2V4I | 0.7 | ![]() |
AYA![]() | N-ACETYLALANINE | A,B,C,D,E,F, G,H | 1VBO | 0.7 | ![]() |
AYA![]() | N-ACETYLALANINE | A,B,C,D | 1J4U | 0.7 | ![]() |
E6C![]() | N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- 2-METHYL-BUTANE | A | 1PPP | 0.71 | ![]() |
E6C![]() | N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- 2-METHYL-BUTANE | A | 1PE6 | 0.71 | ![]() |
E6C![]() | N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- 2-METHYL-BUTANE | A | 1ITO | 0.71 | ![]() |
C99![]() | {(2R)-2-[(1S,2R)-1-AMINO-2-HYDROXYPROPYL]- 2-HYDROXY-4,5-DIOXOIMIDAZOLIDIN- 1-YL}ACETIC ACID | A | 2HCG | 0.75 | ![]() |
PT3![]() | N-PROPYL-TARTRAMIC ACID | A,B,C,D | 2HPA | 0.72 | ![]() |
NCB![]() | N-CARBAMOYL-ALANINE | A,B,C,D,E,F, G,H,I,J | 1QMV | 0.8 | ![]() |
CIR![]() | CITRULLINE | A,B,C,D | 1J21 | 0.7 | ![]() |
CIR![]() | CITRULLINE | B | 1KOD | 0.7 | ![]() |
CIR![]() | CITRULLINE | A,B,C | 3B3I | 0.7 | ![]() |
CIR![]() | CITRULLINE | C | 3DTX | 0.7 | ![]() |
CIR![]() | CITRULLINE | A | 2C6Z | 0.7 | ![]() |
CIR![]() | CITRULLINE | A,C,E,F | 2W65 | 0.7 | ![]() |
CIR![]() | CITRULLINE | A,B | 2JAI | 0.7 | ![]() |
CIR![]() | CITRULLINE | P | 3FT2 | 0.7 | ![]() |
CIR![]() | CITRULLINE | A,B,C,D | 1J1Z | 0.7 | ![]() |
CIR![]() | CITRULLINE | A,B | 1LXY | 0.7 | ![]() |
CIR![]() | CITRULLINE | F,H | 1OL1 | 0.7 | ![]() |
CIR![]() | CITRULLINE | A | 1KP3 | 0.7 | ![]() |
CIR![]() | CITRULLINE | A | 2NZ2 | 0.7 | ![]() |
CIR![]() | CITRULLINE | A | 1H70 | 0.7 | ![]() |
CIR![]() | CITRULLINE | A | 1K97 | 0.7 | ![]() |
CIR![]() | CITRULLINE | C | 3B6S | 0.7 | ![]() |
OLT![]() | O-METHYL-L-THREONINE | A,B,C | 2AOC | 0.72 | ![]() |
OLT![]() | O-METHYL-L-THREONINE | A,B,C | 2AOD | 0.72 | ![]() |
ALO![]() | ALLO-THREONINE | I,P | 1HDT | 0.76 | ![]() |
ALO![]() | ALLO-THREONINE | A | 2JUU | 0.76 | ![]() |
ALO![]() | ALLO-THREONINE | A | 2VMX | 0.76 | ![]() |
PCV![]() | 5-AMINO-3-HYDROXY-2-(2-OXO-AZETIDIN- 1-YL)-PENTANOIC ACID | A | 1DRT | 0.72 | ![]() |
HY3![]() | 3-HYDROXYPROLINE | A,B,G | 2G66 | 0.7 | ![]() |