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Download zip file with the complete ligand collection (idealised coordinates & explicit hydrogen atoms) in:
SDF CML PDB mmCif
MSDchem XML FTP area


K
sdf - cml - pdb - cif
POTASSIUM ION

K01
sdf - cml - pdb - cif
N,N -DIETHYL -2 - [ (2 -THIENYLCARBONYL) AMINO] -4,5,6,7 -TETRAHYDRO -1 -BENZOTHIOPHENE -3 -CARBOXAMIDE

K02
sdf - cml - pdb - cif
(5R) -N,N -DIETHYL -5 -METHYL -2 - [ (THIOPHEN -2 -YLCARBONYL) AMINO] -4,5,6,7 -TETRAHYDRO -1 -BENZOTHIOPHENE -3 -CARBOXAMIDE

K03
sdf - cml - pdb - cif
N,N -DIETHYL -5,5 -DIMETHYL -2 - [ (2 -THIENYLCARBONYL) AMINO] -4,5,6,7 -TETRAHYDRO -1 -BENZOTHIOPHENE -3 -CARBOXAMIDE

K05
sdf - cml - pdb - cif
(E) -3,4 -DIHYDROXY -N' - [ (2 -METHOXYNAPHTHALEN -1 -YL) METHYLENE] BENZOHYDRAZIDE

K10
sdf - cml - pdb - cif
1 -TERT -BUTYL -3 - (2,5 -DIMETHYLBENZYL) -1H -PYRAZOLO [3,4 -D] PYRIMIDIN -4 -AMINE

K17
sdf - cml - pdb - cif
4,5,6,7 -TETRABROMO -BENZIMIDAZOLE

K1R
sdf - cml - pdb - cif
(2S) -2 -amino -4 - [ ({ [ (2R) -2 -amino -2 -carboxyethyl] thio}amino) sulfinyl] butanoic acid

K21
sdf - cml - pdb - cif
4 - [3 -{1 - (4 -BENZYL) PIPERODINYL}PROPIONYL] -7 -METHOXY -2,3,4,5 -TERTRAHYDRO -1,4 -BENZOTHIAZEPINE

K22
sdf - cml - pdb - cif
4,5,6,7 -TETRABROMO -1H,3H -BENZIMIDAZOL -2 -THIONE

K25
sdf - cml - pdb - cif
4,5,6,7 -TETRABROMO -N,N -DIMETHYL -1H -BENZIMIDAZOL -2 -AMINE

K2C
sdf - cml - pdb - cif
6,7,12,13 -tetrahydro -5H -indolo [2,3 -a] pyrrolo [3,4 -c] carbazol -5 -one

K32
sdf - cml - pdb - cif
4,5,6,7 -TETRABROMO -1H,3H -BENZIMIDAZOL -2 -ONE

K37
sdf - cml - pdb - cif
4,5,6,7 -TETRABROMO -2 - (METHYLSULFANYL) -1H -BENZIMIDAZOLE

K44
sdf - cml - pdb - cif
5,6,7,8 -TETRABROMO -1 -METHYL -2,3 -DIHYDRO -1H -IMIDAZO [1,2 -A] BENZIMIDAZOLE

K51
sdf - cml - pdb - cif
4 - (6 -{ [ (1S) -1 - (HYDROXYMETHYL) -2 -METHYLPROPYL] AMINO}IMIDAZO [1,2 -B] PYRIDAZIN -3 -YL) BENZONITRILE

K57
sdf - cml - pdb - cif
3 - [2 -HYDROXY -3 - (3 -HYDROXY -2 -METHYL -BENZOYLAMINO) -4 -PHENYL -BUTYRYL] -5,5 -DIMETHYL -THIAZOLIDINE -4 -CARBOXYLIC ACID TERT -BUTYLAMIDE

K64
sdf - cml - pdb - cif
3 - [2 -HYDROXY -3 - (3 -HYDROXY -2 -METHYL -BENZOYLAMINO) -4 -PHENYL -BUTYRYL] -5,5 - DIMETHYL -THIAZOLIDINE -4 -CARBOXYLIC ACID 2 -METHYL -BENZYLAMIDE

K7I
sdf - cml - pdb - cif
L -alanyl -N - [ (1S,2R) -1 -benzyl -2 -hydroxypropyl] -L -alaninamide

K7J
sdf - cml - pdb - cif
N - (3 -carboxypropanoyl) -L -alanyl -L -alanyl -N - [ (1S,2R) -1 -benzyl -2 -hydroxypropyl] -L -prolinamide

KAB
sdf - cml - pdb - cif
KABIRAMIDE C

KAG
sdf - cml - pdb - cif
2' -DEOXY -N - [ (1S) -1 -METHYL -3 -OXOPROPYL] GUANOSINE 5' -PHOSPHATE

KAH
sdf - cml - pdb - cif
5 -amino -4 -hydroxyhexanoic acid

KAI
sdf - cml - pdb - cif
3 - (CARBOXYMETHYL) -4 -ISOPROPENYLPROLINE

KAM
sdf - cml - pdb - cif
N - [7 -KETO -8 -AMINOPELARGONIC ACID] - [3 -HYDROXY -2 -METHYL -5 -PHOSPHONOOXYMETHYL -PYRIDIN -4 -YL -METHANE]

KAN
sdf - cml - pdb - cif
KANAMYCIN A

KAP
sdf - cml - pdb - cif
7 -KETO -8 -AMINOPELARGONIC ACID

KAR
sdf - cml - pdb - cif
3" - (BETA -CHLOROETHYL) -2",4" -DIOXO -3, 5" -SPIRO -OXAZOLIDINO -4 -DEACETOXY -VINBLASTINE

KBG
sdf - cml - pdb - cif
2 -KETO -BETA -D -GLUCOSE

KCP
sdf - cml - pdb - cif
2 - [CARBOXY - (2 -THIOPHEN -2 -YL -ACETYLAMINO) -METHYL] -5 -METHYL -3,6 -DIHYDRO -2H - [1,3] THIAZINE -4 -CARBOXYLIC ACID

KCQ
sdf - cml - pdb - cif
(3S) -3 - [ (2S) -2 -AMINO -3 -OXOBUTYL] PYRROLIDIN -2 -ONE

KCX_LEO2
sdf - cml - pdb - cif
LYSINE NZ -CARBOXYLIC ACID

KCX_LFOH
sdf - cml - pdb - cif
LYSINE NZ -CARBOXYLIC ACID

KCX_LL
sdf - cml - pdb - cif
LYSINE NZ -CARBOXYLIC ACID

KCX_LSN3
sdf - cml - pdb - cif
LYSINE NZ -CARBOXYLIC ACID

KDA
sdf - cml - pdb - cif
(3 -DEOXY -D -MANNO -OCT -2 -ULOSONIC ACID) -2 -O -ALLYL

KDF
sdf - cml - pdb - cif
3 -deoxy -alpha -D -erythro -hex -2 -ulofuranosonic acid

KDG
sdf - cml - pdb - cif
2 -KETO -3 -DEOXYGLUCONATE

KDO
sdf - cml - pdb - cif
3 -DEOXY -D -MANNO -OCT -2 -ULOSONIC ACID

KDP
sdf - cml - pdb - cif
2 -KETO -DEOXY -GALACTOSE

KE4
sdf - cml - pdb - cif
(4R) -5 -AMINO -4 - [ ({3 -HYDROXY -2 -METHYL -5 - [ (PHOSPHONOOXY) METHYL] PYRIDIN -4 -YL}METHYL) AMINO] PENTANOIC ACID

KEF
sdf - cml - pdb - cif
CEFUROXIME (OCT -3 -ENE FORM)

KEG
sdf - cml - pdb - cif
12 -TUNGSTOPHOSPHATE

KET
sdf - cml - pdb - cif
2 - [ (3 -HYDROXY -2 -METHYL -5 -PHOSPHONOOXYMETHYL -PYRIDIN -4 -YLMETHYLENE) -AMINO] -SUCCINIC ACID

KEU
sdf - cml - pdb - cif
N -{4 - [ (1R) -4 - [ (2R,4R,5S) -2,4 -DIAMINO -6 -OXOHEXAHYDROPYRIMIDIN -5 -YL] -1 - (2,2,2 -TRIFLUORO -1,1 -DIHYDROXYETHYL) BUTYL] BENZOYL} -D -GLUTAMIC ACID

KGC
sdf - cml - pdb - cif
N~6~ - [ (2R) -2 -CARBOXY -5 -OXOTETRAHYDROFURAN -2 -YL] -L -LYSINE

KGQ
sdf - cml - pdb - cif
DIETHYL ({4 - [ (2S,3R) -2 - ({ [ (3R,3AS,6AR) -HEXAHYDROFURO [2,3 -B] FURAN -3 -YLOXY] CARBONYL}AMINO) -3 -HYDROXY -4 -{ISOBUTYL [ (4 -METHOXYPHENYL) SULFONYL] AMINO}BUTYL] PHENOXY}METHYL) PHOSPHONATE

KGR
sdf - cml - pdb - cif
5 -KETO -4 -DEOXYGLUCARATE

KGY
sdf - cml - pdb - cif
4 - ({ [4 - (BUT -2 -YN -1 -YLOXY) PHENYL] SULFONYL}METHYL) -1 - [ (3,5 -DIMETHYLISOXAZOL -4 -YL) SULFONYL] -N -HYDROXYPIPERIDINE -4 -CARBOXAMIDE

KH1
sdf - cml - pdb - cif
5 - (2 -{1 - [1 - (4 -ETHYL -4 -HYDROXY -HEXYLOXY) -ETHYL] -7A -METHYL -OCTAHYDRO -INDEN -4 -YLIDENE} -ETHYLIDENE) -4 -METHYLENE -CYCLOHEXANE -1,3 -DIOL

KHA
sdf - cml - pdb - cif
1 - (4 -{ [ (2 -hydroxyethyl) amino] carbonyl}benzyl) -1 -methylpiperidinium

KHO
sdf - cml - pdb - cif
4 - (3,4 -DIHYDROXY -5 -HYDROXYMETHYL -TETRAHYDRO -FURAN -2 -YLOXY) -TETRAHYDRO -PYRAN -2,3,5 -TRIOL

KHP
sdf - cml - pdb - cif
2 -HYDROXYMETHYL -5 - (4 -NITRO -PHENOXY) -TETRAHYDRO -FURAN -3,4 -DIOL

KI2
sdf - cml - pdb - cif
3 -BENZYLOXYCARBONYLAMINO -2 -HYDROXY -4 -PHENYL -BUTYRIC ACID

KIF
sdf - cml - pdb - cif
KIFUNENSINE

KIN
sdf - cml - pdb - cif
1 - [4 - (PYRIDIN -4 -YLOXY) PHENYL] -3 - [3 - (TRIFLUOROMETHYL) PHENYL] UREA

KIQ
sdf - cml - pdb - cif
(1S,6R) -3 -{ [3 - (TRIFLUOROMETHYL) -5,6 -DIHYDRO [1,2,4] TRIAZOLO [4,3 -A] PYRAZIN -7 (8H) -YL] CARBONYL} -6 - (2,4,5 -TRIFLUOROPHENYL) CYCLOHEX -3 -EN -1 -AMINE

KIR
sdf - cml - pdb - cif
KIRROMYCIN

KIV
sdf - cml - pdb - cif
3 -METHYL -2 -OXOBUTANOIC ACID

KJ2
sdf - cml - pdb - cif
4 -{4 - [4 - (3 -aminopropoxy) phenyl] -1H -pyrazol -5 -yl} -6 -chlorobenzene -1,3 -diol

KLN
sdf - cml - pdb - cif
1 -ACETYL -4 - (4 -{ [ (2S,4R) -2 - (2,4 -DICHLOROPHENYL) -2 - (1H -IMIDAZOL -1 -YLMETHYL) -1,3 -DIOXOLAN -4 -YL] METHOXY}PHENYL) PIPERAZINE

KMB
sdf - cml - pdb - cif
2 -AMINO -6 -AMINOMETHYL -8 -PHENYLSULFANYLMETHYL -3H -QUINAZOLIN -4 -ONE

KMP
sdf - cml - pdb - cif
3,5,7 -trihydroxy -2 - (4 -hydroxyphenyl) -4H -chromen -4 -one

KMT
sdf - cml - pdb - cif
4 - (METHYLSULFANYL) -2 -OXOBUTANOIC ACID

KN2
sdf - cml - pdb - cif
4 - (6 -HYDROXY -1H -INDAZOL -3 -YL) BENZENE -1,3 -DIOL

KNI
sdf - cml - pdb - cif
(N -TERT -BUTYL -THIOPROLINE) - (5 -ISOQUINOLYLOXYACETYL -METHYLTHIOALANINE) -ALLOPHENYLNORSTATINE

KO4
sdf - cml - pdb - cif
POTASSIUM ION, 4 WATERS COORDINATED

KOJ
sdf - cml - pdb - cif
5 -hydroxy -2 - (hydroxymethyl) -4H -pyran -4 -one

KOR
sdf - cml - pdb - cif
L -HOMOCYSTEINE -S -N -S -L -CYSTEINE

KOS
sdf - cml - pdb - cif
17 -DESMETHOXY -17 -N,N -DIMETHYLAMINOETHYLAMINO -GELDANAMYCIN

KPA
sdf - cml - pdb - cif
2 -OXO -5 -PHOSPHONOPENTANOIC ACID

KPC
sdf - cml - pdb - cif
(2 - [2 -KETOPROPYLTHIO] ETHANESULFONATE

KPH
sdf - cml - pdb - cif
LYSINE PHOSPHINIC ACID GROUP

KPL
sdf - cml - pdb - cif
KETOPANTOATE

KPV
sdf - cml - pdb - cif
5 -PHENYL -2 -KETO -VALERIC ACID

KR
sdf - cml - pdb - cif
KRYPTON

KR2
sdf - cml - pdb - cif
(2R) -4 - (2 -BENZOYL -1,2 -DIAZEPAN -1 -YL) -4 -OXO -1 - (2,4,5 -TRIFLUOROPHENYL) BUTAN -2 -AMINE

KRA
sdf - cml - pdb - cif
KURASOIN A

KRB
sdf - cml - pdb - cif
KURASOIN B

KRI
sdf - cml - pdb - cif
(S) -2 -AMINO -4 - [ (2S,3R) -2,3,5 -TRIHYDROXY -4 -OXO -PENTYL] MERCAPTO -BUTYRIC ACID

KSA
sdf - cml - pdb - cif
K -252A

KSG
sdf - cml - pdb - cif
(1S,2R,3S,4R,5S,6S) -2,3,4,5,6 -PENTAHYDROXYCYCLOHEXYL 2 -AMINO -4 -{ [CARBOXY (IMINO) METHYL] AMINO} -2,3,4,6 -TETRADEOXY -ALPHA -D -ARABINO -HEXOPYRANOSIDE

KST
sdf - cml - pdb - cif
N~6~ - (5 -CARBOXY -3 -THIENYL) -L -LYSINE

KT3
sdf - cml - pdb - cif
N -{4 -4 - (2,4 -DIAMINO -6 -OXO -1,6 -DIHYDRO -PYRIMIDIN -5 -YL) -1 - (2,2,2 -TRIFLUORO -1,1 -DIHYDROXY -ETHYL) -BUT -2 -YL -BENZOYL} -GAMMA -GLUTAMYL -GAMMA -GLUTAMYL -GLUTAMIC ACID

KT5
sdf - cml - pdb - cif
N -{4 -4 - (2,4 -DIAMINO -6 -OXO -1,6 -DIHYDRO -PYRIMIDIN -5 -YL) -1 - (2,2,2 -TRIFLUORO -1,1 -DIHYDROXY -ETHYL) -BUT -2 -YL -BENZOYL} -GAMMA -GLUTAMYL -GAMMA -GLUTAMYL -GAMMA -GLUTAMYL -GAMMA -GLUTAMYL -GLUTAMIC ACID

KTA
sdf - cml - pdb - cif
(S) -CYCLOHEXANONE -2 -ACETATE

KTH
sdf - cml - pdb - cif
2 -KETOTHIAZOLE

KTN
sdf - cml - pdb - cif
CIS -1 -ACETYL -4 - (4 - ( (2 - (2,4 -DICHLOROPHENYL) -2 - (1H -IMIDAZOL -1 -YLMETHYL) -1,3 -DIOXOLAN -4 -YL) METHOXY) PHENYL) PIPERAZINE

KTP
sdf - cml - pdb - cif
(2 -NAPHTHALEN -2 -YL -1 -NAPHTHALEN -1 -YL -2 -OXO -ETHYL) -PHOSPHONIC ACID

KU8
sdf - cml - pdb - cif
4 - [3 - (1,4 -diazepan -1 -ylcarbonyl) -4 -fluorobenzyl] phthalazin -1 (2H) -one

KWT
sdf - cml - pdb - cif
(1S,6BR,9AS,11R,11BR) -9A,11B -DIMETHYL -1 - [ (METHYLOXY) METHYL] -3,6,9 -TRIOXO -1,6,6B,7,8,9,9A,10,11,11B -DECAHYDRO -3H -FURO [4,3,2 -DE] INDENO [4,5 -H] [2] BENZOPYRAN -11 -YL ACETATE

KY1
sdf - cml - pdb - cif
4 - (2 -aminophenyl) -4 -oxobutanoic acid

KYN
sdf - cml - pdb - cif
KYNURENINE
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