Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03076351
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 |
M6R | 5-AMINO-5-DEOXY-1-O-PHOSPHONO-D- MANNITOL | A,B,C,D | 2PUV | 0.72 | |
5AX | 2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL | A | 2JCQ | 0.7 | |
5AX | 2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL | A,B | 2IH9 | 0.7 | |
5AX | 2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL | A,B,C,D,E,F | 2J2P | 0.7 | |
5AX | 2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL | A | 3DIV | 0.7 | |
CTS | CASTANOSPERMINE | A | 1EQC | 0.74 | |
CTS | CASTANOSPERMINE | A,B | 2JKP | 0.74 | |
CTS | CASTANOSPERMINE | A,B,C | 2VL8 | 0.74 | |
CTS | CASTANOSPERMINE | A,B | 2CBU | 0.74 | |
CTS | CASTANOSPERMINE | A,B | 2PWG | 0.74 | |
IFM | 5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINE | A | 1UP2 | 0.71 | |
IFM | 5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINE | A,B,C,D | 3GXF | 0.71 | |
IFM | 5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINE | A | 1OCN | 0.71 | |
IFM | 5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINE | A,B,C,D | 2NSX | 0.71 | |
IFM | 5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINE | A,B | 1OIF | 0.71 | |
IFM | 5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINE | A | 1OCQ | 0.71 | |
IFM | 5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINE | A | 2G9V | 0.71 | |
AOL | (1R,2R,3S,4S,5R)-5-AMINOCYCLOPENTANE- 1,2,3,4-TETROL | A | 2F7Q | 0.78 | |
3CU | CASUARINE | A,B,C,D | 2JJB | 0.74 | |
3CU | CASUARINE | A | 3CTT | 0.74 | |
HYP | 4-HYDROXYPROLINE | A | 1OB4 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C | 1QSU | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,C,E,G,I,K, M,O | 1GK8 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 2V6A | 0.71 | |
HYP | 4-HYDROXYPROLINE | E,F,G,H,I,J | 2F6A | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1TCH | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1KCP | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 2JTU | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C,I,J,L,M | 1K83 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 3E2Q | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1TR6 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1P1P | 0.71 | |
HYP | 4-HYDROXYPROLINE | B,C,E,F,H,I, K,L,M,N,O,P, Q,R,S,T | 2HOD | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C,D | 2V53 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 2V68 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 2VUV | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1EYO | 0.71 | |
HYP | 4-HYDROXYPROLINE | D,H | 2FES | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,E,F | 3EJH | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 2JQB | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 2P4L | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 2H9X | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1AV3 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1TCJ | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 2IHA | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C | 1BKV | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1R9U | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1AG7 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1GQ0 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1R9I | 0.71 | |
HYP | 4-HYDROXYPROLINE | H | 1LM8 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C,E,F,H, J,K,M,O,P,R, T,V,W | 1UZH | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C,D,E,F | 1EI8 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C | 1Q7D | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1VIB | 0.71 | |
HYP | 4-HYDROXYPROLINE | D,H | 2FEQ | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1DG0 | 0.71 | |
HYP | 4-HYDROXYPROLINE | B,C,D,F | 1DZI | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1GIB | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,D | 1LQB | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C | 3DMW | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 2JQC | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C,D,E,F | 1X1K | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1IEO | 0.71 | |
HYP | 4-HYDROXYPROLINE | D,H | 1NZQ | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 2JRY | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 2V67 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B | 1JOH | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1PQR | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1TTL | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 2B5Q | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C | 1CAG | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 2EW4 | 0.71 | |
HYP | 4-HYDROXYPROLINE | B,C,E,F,G,H | 2HLO | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 2YYF | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1G1P | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,D,E,H,K, O,R,V | 1UWA | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C,E,H,I, J,K,M,O,P,R, T,V,W | 1UW9 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 2VUZ | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1QFB | 0.71 | |
HYP | 4-HYDROXYPROLINE | D,H | 1O0D | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C,D,E,F | 2D3F | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 2J15 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1DFZ | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B | 1OB6 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C,I,J,L,M | 3CQZ | 0.71 | |
HYP | 4-HYDROXYPROLINE | 1,2,3,4,5,6, 7,8,A,B,C,D, E,F,G,H,I,J, K,L,M,N,O,P, S,T,U,V,W,X, Y,Z | 1IR2 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1TCK | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1G1Z | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,D,E,F,G | 1YM8 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 2VDI | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1MTQ | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C,E,F,H, I,J,K,M,O,P, R,T,V,W | 1UZD | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C | 1V7H | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,G | 2G66 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1OB7 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1OMC | 0.71 | |
HYP | 4-HYDROXYPROLINE | X | 2HCZ | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1DFY | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C,D,E,F | 2D3H | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 2VDH | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 2V63 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1IH9 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 2IH6 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 2IH7 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1JLP | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,C,E,F | 2W65 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1AS5 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C | 1V6Q | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C | 1V4F | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C | 1Y0F | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C | 2DRX | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1K64 | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C | 1YGV | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 2B5P | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C | 2DRT | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 2CCO | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1WCT | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1D7T | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1JLO | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C | 1CGD | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 2V69 | 0.71 | |
HYP | 4-HYDROXYPROLINE | H,P | 2A2X | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1DLZ | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C,I,J,L, M,T | 2VUM | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1TCG | 0.71 | |
HYP | 4-HYDROXYPROLINE | H,P | 2ANK | 0.71 | |
HYP | 4-HYDROXYPROLINE | A,B,C | 1WZB | 0.71 | |
HYP | 4-HYDROXYPROLINE | A | 1BDK | 0.71 | |
AGP | 2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATE | A,B,C,D,E,F | 1NE7 | 0.72 | |
AGP | 2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATE | A | 2ZJ4 | 0.72 | |
AGP | 2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATE | A | 1MOS | 0.72 | |
AGP | 2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATE | A,B | 1HOR | 0.72 | |
MMN | 5-DEOXY-5-{[(1S)-1-HYDROXYETHYL]AMINO}- D-GLUCITOL | A | 1XUZ | 0.84 | |
DMJ | 1-DEOXYMANNOJIRIMYCIN | A,B | 1KRE | 0.87 | |
DMJ | 1-DEOXYMANNOJIRIMYCIN | A | 1FO2 | 0.87 | |
DMJ | 1-DEOXYMANNOJIRIMYCIN | A | 1G6I | 0.87 | |
DMJ | 1-DEOXYMANNOJIRIMYCIN | A | 1HXK | 0.87 | |
NOJ | 1-DEOXYNOJIRIMYCIN | A,B | 1OIM | 0.87 | |
NOJ | 1-DEOXYNOJIRIMYCIN | A,B | 2J77 | 0.87 | |
NOJ | 1-DEOXYNOJIRIMYCIN | A,B | 2JKE | 0.87 | |
NOJ | 1-DEOXYNOJIRIMYCIN | A | 3GBE | 0.87 | |
NOJ | 1-DEOXYNOJIRIMYCIN | A,B | 3GXT | 0.87 | |
NOJ | 1-DEOXYNOJIRIMYCIN | A,B | 1DIE | 0.87 | |
NOJ | 1-DEOXYNOJIRIMYCIN | A | 1DOG | 0.87 | |
NOJ | 1-DEOXYNOJIRIMYCIN | A,B | 1I75 | 0.87 | |
NOJ | 1-DEOXYNOJIRIMYCIN | A,B | 2PWD | 0.87 | |
YRR | 3-HYDROXY-PYRROLIDIN-2-YLMETHYL- MONOPHOSPHATE GROUP | A,D | 1F6O | 0.79 | |
YRR | 3-HYDROXY-PYRROLIDIN-2-YLMETHYL- MONOPHOSPHATE GROUP | D | 1BNK | 0.79 | |
GHA | A | 1TQU | 0.75 | ||
H4P | 1-DEOXY-6-O-PHOSPHONO-1-[(PHOSPHONOMETHYL)AMINO]- L-THREO-HEXITOL | A,B | 1PCW | 0.74 | |
SWA | 1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B- TRIOL | A | 1HWW | 0.7 | |
SWA | 1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B- TRIOL | A | 3BLB | 0.7 | |
XDN | PIPERIDINE-3,4,5-TRIOL | A | 1V0K | 0.72 | |
XDN | PIPERIDINE-3,4,5-TRIOL | A | 1V0M | 0.72 | |
XDN | PIPERIDINE-3,4,5-TRIOL | A | 1FH7 | 0.72 | |
NOZ | (2S,3S,4R,5R)-5-(hydroxymethyl)piperidine- 2,3,4-triol | A,B | 2VL4 | 0.73 | |
2TB | 1,3-DIAMINO-4,5,6-TRIHYDROXY-CYCLOHEXANE | A | 2TOB | 0.72 | |
DQQ | 2,5-DIDEOXY-2,5-IMINO-D-MANNITOL | A | 2AEY | 0.95 | |
YHO | (1S,2S,3R,4R)-4-aminocyclopentane- 1,2,3-triol | A | 3DX1 | 0.76 | |
NND | (2R,3R,4R,5S)-2-(HYDROXYMETHYL)- 1-NONYLPIPERIDINE-3,4,5-TRIOL | A,B | 2V3E | 0.72 | |
CYY | 2-DEOXYSTREPTAMINE | A | 1QD3 | 0.73 | |
GTL | (2E,3R,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)-2-PIPERIDINONE | A,B | 2J79 | 0.72 | |
GTL | (2E,3R,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)-2-PIPERIDINONE | A,B | 1UWT | 0.72 | |
DIG | 2,5-DIDEOXY-2,5-IMINO-D-GLUCITOL | A,B | 1DID | 0.95 | |
0AZ | (4R)-4-hydroxy-L-proline | A | 1GQ0 | 0.71 | |
NOY | (2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE- 2,3,4-TRIOL | A,B | 2J75 | 0.73 | |
NOY | (2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE- 2,3,4-TRIOL | A | 2V3G | 0.73 | |
NOY | (2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE- 2,3,4-TRIOL | A,B | 2VQU | 0.73 | |
XIF | PIPERIDINE-3,4-DIOL | A | 1V0L | 0.7 | |
XIF | PIPERIDINE-3,4-DIOL | A | 1V0N | 0.7 | |
XIF | PIPERIDINE-3,4-DIOL | A | 1FH8 | 0.7 | |
IMR | IMINORIBITOL | A,B,C | 1I80 | 0.91 | |
GOO | (1R,2R,3R,4S,5R)-4-amino-5-methoxycyclopentane- 1,2,3-triol | A | 3DX4 | 0.72 | |
1AB | 1,4-DIDEOXY-1,4-IMINO-D-ARABINITOL | A | 2G9Q | 0.91 | |
NEB | 2-DEOXY-D-STREPTAMINE | A | 1NEM | 0.73 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 1L5Q | 0.7 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 3CEM | 0.7 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 1L5R | 0.7 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 1EXV | 0.7 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 1L5S | 0.7 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 1L7X | 0.7 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A | 1WW2 | 0.7 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A | 2PRJ | 0.7 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 1FC0 | 0.7 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 3CEJ | 0.7 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 3CEH | 0.7 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 1XOI | 0.7 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 3DDW | 0.7 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 1EM6 | 0.7 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 3DDS | 0.7 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 3DD1 | 0.7 | |
YTB | (1R,2R,3S,4R,5R)-5-aminocyclopentane- 1,2,3,4-tetrol | A | 3DX3 | 0.78 | |
MNM | (2S,3S,4R,5R)-2,3,4-TRIHYDROXY- 5-HYDROXYMETHYL-PIPERIDINE | A | 2ALW | 0.73 | |
DFU | (2S,3R,4S,5R)-2-METHYLPIPERIDINE- 3,4,5-TRIOL | A,B | 2EAC | 0.77 | |
GOX | (2S,3S,4R,5R)-6-(HYDROXYAMINO)- 2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE- 3,4,5-TRIOL | A,B | 1UWU | 0.72 | |
GOX | (2S,3S,4R,5R)-6-(HYDROXYAMINO)- 2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE- 3,4,5-TRIOL | A | 3D51 | 0.72 | |
GOX | (2S,3S,4R,5R)-6-(HYDROXYAMINO)- 2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE- 3,4,5-TRIOL | A | 1U30 | 0.72 | |
GOX | (2S,3S,4R,5R)-6-(HYDROXYAMINO)- 2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE- 3,4,5-TRIOL | M | 1E72 | 0.72 | |
GOX | (2S,3S,4R,5R)-6-(HYDROXYAMINO)- 2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE- 3,4,5-TRIOL | A,B | 2J78 | 0.72 | |
GOX | (2S,3S,4R,5R)-6-(HYDROXYAMINO)- 2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE- 3,4,5-TRIOL | A | 1U2Y | 0.72 | |
GOX | (2S,3S,4R,5R)-6-(HYDROXYAMINO)- 2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE- 3,4,5-TRIOL | M,N | 1E6S | 0.72 | |
CGB | CALYSTEGINE B2 | A,B | 2CBV | 0.85 | |
NBV | (2R,3R,4R,5S)-1-BUTYL-2-(HYDROXYMETHYL)PIPERIDINE- 3,4,5-TRIOL | A,B | 2V3D | 0.74 | |
HY3 | 3-HYDROXYPROLINE | A,B,G | 2G66 | 0.7 |