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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02989853

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DOA12-AMINO-DODECANOIC ACIDB1EOJ0.75
DOA12-AMINO-DODECANOIC ACIDA,D1H8T0.75
DOA12-AMINO-DODECANOIC ACIDA2DCX0.75
DOA12-AMINO-DODECANOIC ACIDB1EOL0.75
ACA6-AMINOHEXANOIC ACIDA,B2JT90.77
ACA6-AMINOHEXANOIC ACIDA,B1CEA0.77
ACA6-AMINOHEXANOIC ACIDC1ILP0.77
ACA6-AMINOHEXANOIC ACIDA2PK40.77
ACA6-AMINOHEXANOIC ACID1,2,4,5,A,B,
C,D,E,J,K,L,
M,N,O,P,R,S,
T,U,V,Z
1M900.77
ACA6-AMINOHEXANOIC ACID0,1,3,4,5,9,
A,B,C,H,J,K,
L,M,N,O,Q,R,
S,T,U,Y,Z
1VQ60.77
ACA6-AMINOHEXANOIC ACID0,2,4,9,A,B,
C,H,I,J,K,L,
M,N,P,Q,R,S,
T,X,Y,Z
1KQS0.77
ACA6-AMINOHEXANOIC ACIDA1PK20.77
ACA6-AMINOHEXANOIC ACIDA2ZM70.77
ACA6-AMINOHEXANOIC ACID0,1,2,3,6,9,
A,B,C,D,F,H,
J,K,L,M,N,O,
Q,R,S,T,U,Y,Z
3CMA0.77
ACA6-AMINOHEXANOIC ACIDC1ILQ0.77
ACA6-AMINOHEXANOIC ACIDA2ZM80.77
ACA6-AMINOHEXANOIC ACID0,1,3,4,9,A,
B,C,D,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z
1VQK0.77
ACA6-AMINOHEXANOIC ACIDA2DCF0.77
ACA6-AMINOHEXANOIC ACIDA1HPK0.77
ACA6-AMINOHEXANOIC ACID0,1,3,4,9,A,
B,C,D,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z
1VQ80.77
ACA6-AMINOHEXANOIC ACID0,1,2,3,6,9,
A,B,C,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z
3CME0.77
ACA6-AMINOHEXANOIC ACIDA2ZM90.77
ACA6-AMINOHEXANOIC ACID0,1,2,3,4,5,
9,A,B,C,D,F,
H,J,K,L,M,N,
O,Q,R,S,T,U,
Y,Z
1VQN0.77
ACA6-AMINOHEXANOIC ACIDA2ZMA0.77
ACA6-AMINOHEXANOIC ACIDA3KIV0.77
ACA6-AMINOHEXANOIC ACID0,1,3,4,9,A,
B,C,D,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z
1VQ90.77
APP1-ACETYL-2-CARBOXYPIPERIDINEA,B,C,D,F,Q1EFR0.74
BRR(2R)-2-{[FORMYL(HYDROXY)AMINO]METHYL}HEXANOIC ACIDA,B1RL40.71
DNMN-METHYL-D-NORLEUCINEA,B1S1O0.74
DNMN-METHYL-D-NORLEUCINEA,B1S4A0.74
DNMN-METHYL-D-NORLEUCINEA1R9V0.74
NWA4,4-DIHYDROXY-N,N,N-TRIMETHYLPENTAN-
1-AMINIUM
A2C5F0.71
NWA4,4-DIHYDROXY-N,N,N-TRIMETHYLPENTAN-
1-AMINIUM
A,B2HA00.71
DM0N~2~,N~2~,N~6~,N~6~-tetramethyl-
L-lysine
A132L0.86
LYPN~6~-METHYL-N~6~-PROPYL-L-LYSINEA,E2UXN0.81
LDHN~6~-ETHYL-L-LYSINEA,K2IOF0.78
VIG4-AMINO HEXANOIC ACIDA,B,C,D1OHW0.71
AB52(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2AEB0.71
M3LN-TRIMETHYLLYSINEA1YCC0.83
M3LN-TRIMETHYLLYSINEA1FHB0.83
M3LN-TRIMETHYLLYSINEA1CIH0.83
M3LN-TRIMETHYLLYSINET3FDT0.83
M3LN-TRIMETHYLLYSINEB1PDQ0.83
M3LN-TRIMETHYLLYSINEA,B,D,E2V870.83
M3LN-TRIMETHYLLYSINEA,B,C,D,E2V830.83
M3LN-TRIMETHYLLYSINEA2YCC0.83
M3LN-TRIMETHYLLYSINEA1CTY0.83
M3LN-TRIMETHYLLYSINEA1YEA0.83
M3LN-TRIMETHYLLYSINEA,B,C,D2PNX0.83
M3LN-TRIMETHYLLYSINEB,D,F,H3DM10.83
M3LN-TRIMETHYLLYSINEA1CHI0.83
M3LN-TRIMETHYLLYSINEB2H9P0.83
M3LN-TRIMETHYLLYSINEA,P2JMJ0.83
M3LN-TRIMETHYLLYSINEA,B,I,J2P5B0.83
M3LN-TRIMETHYLLYSINEP1KNE0.83
M3LN-TRIMETHYLLYSINEC,D2GFA0.83
M3LN-TRIMETHYLLYSINEA,B,F,G2Q8C0.83
M3LN-TRIMETHYLLYSINEA1CSW0.83
M3LN-TRIMETHYLLYSINED2B2U0.83
M3LN-TRIMETHYLLYSINEA1CHH0.83
M3LN-TRIMETHYLLYSINEA,B,C2VNF0.83
M3LN-TRIMETHYLLYSINEA1IRV0.83
M3LN-TRIMETHYLLYSINEA1CIE0.83
M3LN-TRIMETHYLLYSINEA,B,C,D2B2T0.83
M3LN-TRIMETHYLLYSINEC,D2H6Q0.83
M3LN-TRIMETHYLLYSINEA1CHJ0.83
M3LN-TRIMETHYLLYSINEA1RAQ0.83
M3LN-TRIMETHYLLYSINEA,P2K170.83
M3LN-TRIMETHYLLYSINEA1YEB0.83
M3LN-TRIMETHYLLYSINEA,B,D,E2V850.83
M3LN-TRIMETHYLLYSINEA1YIC0.83
M3LN-TRIMETHYLLYSINEA,B,D,E2V890.83
M3LN-TRIMETHYLLYSINEA1CRG0.83
M3LN-TRIMETHYLLYSINEA1CIF0.83
M3LN-TRIMETHYLLYSINEA1CSU0.83
M3LN-TRIMETHYLLYSINEA,B1UP50.83
M3LN-TRIMETHYLLYSINEA1PRW0.83
M3LN-TRIMETHYLLYSINEA,B3DB30.83
M3LN-TRIMETHYLLYSINEA,B3GL60.83
M3LN-TRIMETHYLLYSINEA1RAP0.83
M3LN-TRIMETHYLLYSINEA1CSV0.83
M3LN-TRIMETHYLLYSINEA1CRJ0.83
M3LN-TRIMETHYLLYSINEA1YFC0.83
M3LN-TRIMETHYLLYSINEA,B,C2H230.83
M3LN-TRIMETHYLLYSINEA,B,C,D2OQ60.83
M3LN-TRIMETHYLLYSINEA,B,C,P2F6J0.83
M3LN-TRIMETHYLLYSINEA,B2KGI0.83
M3LN-TRIMETHYLLYSINEA,B1PFB0.83
M3LN-TRIMETHYLLYSINEA1CTZ0.83
M3LN-TRIMETHYLLYSINEA,C,D,E,L,N,
O,P,W
3CX50.83
M3LN-TRIMETHYLLYSINEA,B,P2YYR0.83
M3LN-TRIMETHYLLYSINEC,D2QQS0.83
M3LN-TRIMETHYLLYSINEB3GV60.83
M3LN-TRIMETHYLLYSINEA,B,C2W9K0.83
M3LN-TRIMETHYLLYSINEA1CCR0.83
M3LN-TRIMETHYLLYSINEA,B2G6Q0.83
M3LN-TRIMETHYLLYSINEA,C,D,E,L,N,
O,P,W
3CXH0.83
M3LN-TRIMETHYLLYSINEA1CRI0.83
M3LN-TRIMETHYLLYSINEA,B,C,D2OS20.83
M3LN-TRIMETHYLLYSINEA,B,D,E2V860.83
M3LN-TRIMETHYLLYSINEA1CRH0.83
M3LN-TRIMETHYLLYSINEA1IRW0.83
M3LN-TRIMETHYLLYSINEA,B,F,G2Q8E0.83
M3LN-TRIMETHYLLYSINEA,B2FUU0.83
M3LN-TRIMETHYLLYSINEA,B2QIC0.83
M3LN-TRIMETHYLLYSINEA1CIG0.83
M3LN-TRIMETHYLLYSINEA1CSX0.83
M3LN-TRIMETHYLLYSINED2B2W0.83
M3LN-TRIMETHYLLYSINEA1YTC0.83
M3LN-TRIMETHYLLYSINEA,P3G7L0.83
M3LN-TRIMETHYLLYSINEC,D,E,N,O,P,W1KYO0.83
M3LN-TRIMETHYLLYSINEA,B,C,D3C6W0.83
DNN7,8-DIAMINO-NONANOIC ACIDA1DAH0.71
DNN7,8-DIAMINO-NONANOIC ACIDA1A820.71
NLENORLEUCINEA1MMT0.73
NLENORLEUCINEA,B1JB60.73
NLENORLEUCINEC1K2B0.73
NLENORLEUCINEA,B,C2AVQ0.73
NLENORLEUCINEC,D,I,L1R1L0.73
NLENORLEUCINEE,S2RLN0.73
NLENORLEUCINEE,S1Z3L0.73
NLENORLEUCINEA,B,C2AOD0.73
NLENORLEUCINEA,B,C2J9J0.73
NLENORLEUCINEA,B,I4HVP0.73
NLENORLEUCINEA,B,C2AVM0.73
NLENORLEUCINEB,C1K1T0.73
NLENORLEUCINEA,B,C2AOC0.73
NLENORLEUCINEA,B,C2JE40.73
NLENORLEUCINEA,B,I3DCK0.73
NLENORLEUCINEB1EOL0.73
NLENORLEUCINEA1FF00.73
NLENORLEUCINEA1FG60.73
NLENORLEUCINEA1FGC0.73
NLENORLEUCINEE,S1Z3M0.73
NLENORLEUCINEA2RME0.73
NLENORLEUCINEB1FGL0.73
NLENORLEUCINEC1K1U0.73
NLENORLEUCINEA,B1B7H0.73
NLENORLEUCINEA1HTH0.73
NLENORLEUCINEA,B,D2J9K0.73
NLENORLEUCINEA2RMD0.73
NLENORLEUCINEA,B,C2AOG0.73
NLENORLEUCINEA2RMI0.73
NLENORLEUCINEI1EPO0.73
NLENORLEUCINEA1FFI0.73
NLENORLEUCINEA1HD90.73
NLENORLEUCINEA1FFF0.73
NLENORLEUCINEB2JND0.73
NLENORLEUCINEA1FEJ0.73
NLENORLEUCINEA2K9E0.73
NLENORLEUCINEC1CFN0.73
NLENORLEUCINEC1K2C0.73
NLENORLEUCINEA1WY40.73
NLENORLEUCINEA1FQ80.73
NLENORLEUCINEA,B1S1O0.73
NLENORLEUCINEA2F4K0.73
NLENORLEUCINEA,B1D5E0.73
NLENORLEUCINEA2JX40.73
NLENORLEUCINEA1FG80.73
NLENORLEUCINEA1WY30.73
NLENORLEUCINEI1YTJ0.73
NLENORLEUCINEA,B,I3DCR0.73
NLENORLEUCINEA,I2O400.73
NLENORLEUCINEA,B2GYP0.73
NLENORLEUCINEC,F1A8K0.73
NLENORLEUCINEC1BAI0.73
NLENORLEUCINEA,B2JT90.73
NLENORLEUCINEA2RM90.73
NLENORLEUCINEA,B1DAZ0.73
NLENORLEUCINEA1F3R0.73
NLENORLEUCINEA,I2JXR0.73
NLENORLEUCINEC,F1A940.73
NLENORLEUCINEA,B1S4A0.73
NLENORLEUCINEA1R9V0.73
NLENORLEUCINEA,B,C,D,E,F2Z2T0.73
MLZN-METHYL-LYSINEA,B,I,J2PXJ0.77
MLZN-METHYL-LYSINEA,B,E,F1XQH0.77
MLZN-METHYL-LYSINEA,B,C,D2G460.77
MLZN-METHYL-LYSINED2B2V0.77
MLZN-METHYL-LYSINEA,B3CBM0.77
MLZN-METHYL-LYSINEA,B,C,D2OT70.77
MLZN-METHYL-LYSINEA,B,E,F3F9Y0.77
MLZN-METHYL-LYSINEP1Q3L0.77
MLZN-METHYL-LYSINEA,B,E,F2BQZ0.77
MLZN-METHYL-LYSINEA2RHY0.77
MLZN-METHYL-LYSINEA,B2F690.77
MLZN-METHYL-LYSINEA2R5A0.77
MLZN-METHYL-LYSINEA,B3F700.77
MLZN-METHYL-LYSINEA,B,C2H2J0.77
MLZN-METHYL-LYSINEC,D2H6K0.77
MLZN-METHYL-LYSINEA3EPQ0.77
MLZN-METHYL-LYSINEA,B2QNU0.77
MLZN-METHYL-LYSINEA,B,C,D3HHL0.77
MLZN-METHYL-LYSINEA1IV80.77
MLZN-METHYL-LYSINEA1XER0.77
MLZN-METHYL-LYSINEB,D2H9N0.77
MLZN-METHYL-LYSINEL2R5M0.77
MLZN-METHYL-LYSINEA3E3X0.77
MLZN-METHYL-LYSINEA,B2VYT0.77
MLZN-METHYL-LYSINEA,B,K,L1O9S0.77
MLZN-METHYL-LYSINEA,B,C1P0Y0.77
MLZN-METHYL-LYSINEA,B3CBO0.77
ALYN(6)-ACETYLLYSINEA,B2B4D0.72
ALYN(6)-ACETYLLYSINEA,B2OD90.72
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVR0.72
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVS0.72
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVQ0.72
ALYN(6)-ACETYLLYSINEA,B,C,D2OT70.72
ALYN(6)-ACETYLLYSINEA,B2B5G0.72
ALYN(6)-ACETYLLYSINEA2GIV0.72
ALYN(6)-ACETYLLYSINEB2RNY0.72
ALYN(6)-ACETYLLYSINEA1JSP0.72
ALYN(6)-ACETYLLYSINEA,B,I,L2V5W0.72
ALYN(6)-ACETYLLYSINEA,D3D4B0.72
ALYN(6)-ACETYLLYSINEA,B,C,D2OQ60.72
ALYN(6)-ACETYLLYSINEA,B2R0Y0.72
ALYN(6)-ACETYLLYSINEA3CZ70.72
ALYN(6)-ACETYLLYSINEA1JM40.72
ALYN(6)-ACETYLLYSINEA,B2H4H0.72
ALYN(6)-ACETYLLYSINEA,B2J6V0.72
ALYN(6)-ACETYLLYSINEA,B2R100.72
ALYN(6)-ACETYLLYSINEA,B1YC50.72
ALYN(6)-ACETYLLYSINEA,B,C,D2OX00.72
ALYN(6)-ACETYLLYSINEA,B2H2G0.72
ALYN(6)-ACETYLLYSINEA,D2H4F0.72
ALYN(6)-ACETYLLYSINEA2OU20.72
ALYN(6)-ACETYLLYSINEA,B1S5P0.72
ALYN(6)-ACETYLLYSINEB2RNW0.72
ALYN(6)-ACETYLLYSINEA3D350.72
ALYN(6)-ACETYLLYSINEA,B2OD20.72
ALYN(6)-ACETYLLYSINEA2ZFN0.72
ALYN(6)-ACETYLLYSINEC,D2C1J0.72
ALYN(6)-ACETYLLYSINEA,B2QQG0.72
ALYN(6)-ACETYLLYSINEB2RNX0.72
ALYN(6)-ACETYLLYSINEA,B1MA30.72
ALYN(6)-ACETYLLYSINEA,B2H2H0.72
ALYN(6)-ACETYLLYSINEA2I2Z0.72
ALYN(6)-ACETYLLYSINEA,B2OD70.72
ALYN(6)-ACETYLLYSINEP1E6I0.72
ALYN(6)-ACETYLLYSINEA,B1SZC0.72
ALYN(6)-ACETYLLYSINEA,B,C,D,I,J,
K,L
3EWF0.72
ALYN(6)-ACETYLLYSINEA,B2H2D0.72
ALYN(6)-ACETYLLYSINEA,B1Q1A0.72
ALYN(6)-ACETYLLYSINEA,B1SZD0.72
ALYN(6)-ACETYLLYSINEQ,R2E3K0.72
ALYN(6)-ACETYLLYSINEA2OZU0.72
ALYN(6)-ACETYLLYSINEA,B2QQF0.72
ALYN(6)-ACETYLLYSINEA,B,C2R0V0.72
HC5(R)-3-CARBOXY-2-(HEXANOYLOXY)-N,N,N-
TRIMETHYLPROPAN-1-AMINIUM
A,B2H3W0.72
DNED-NORLEUCINEA1R9V0.73
DNED-NORLEUCINEA,B1S4A0.73
DNED-NORLEUCINEA,B1S1O0.73
MNL4,N-DIMETHYLNORLEUCINEC1CWC0.71
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B1O5K0.74
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B3CPR0.74
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B2VC60.74
LP66-piperidin-1-yl-L-norleucineA,B2W7Z0.75
MLYN-DIMETHYL-LYSINEB2G9A0.83
MLYN-DIMETHYL-LYSINEB,D2O9K0.83
MLYN-DIMETHYL-LYSINES,V1I840.83
MLYN-DIMETHYL-LYSINEA,B2VD80.83
MLYN-DIMETHYL-LYSINEA,B1YYV0.83
MLYN-DIMETHYL-LYSINEA2R8D0.83
MLYN-DIMETHYL-LYSINEA2RHU0.83
MLYN-DIMETHYL-LYSINEA,B2P4P0.83
MLYN-DIMETHYL-LYSINEC,D2H6N0.83
MLYN-DIMETHYL-LYSINEA,B,P3B950.83
MLYN-DIMETHYL-LYSINEA,B1Z1Y0.83
MLYN-DIMETHYL-LYSINEA,B2QHQ0.83
MLYN-DIMETHYL-LYSINEA2P6V0.83
MLYN-DIMETHYL-LYSINEA,B,D,F2V880.83
MLYN-DIMETHYL-LYSINEC,D2G990.83
MLYN-DIMETHYL-LYSINEA,B2RHI0.83
MLYN-DIMETHYL-LYSINEA,B,C,P2FSA0.83
MLYN-DIMETHYL-LYSINEB,D2RJF0.83
MLYN-DIMETHYL-LYSINEA1VK10.83
MLYN-DIMETHYL-LYSINEA2RHX0.83
MLYN-DIMETHYL-LYSINEA1IV80.83
MLYN-DIMETHYL-LYSINEA,D,G,J,M,P1O1G0.83
MLYN-DIMETHYL-LYSINEA,B,C1XKP0.83
MLYN-DIMETHYL-LYSINEA,B,C2O3F0.83
MLYN-DIMETHYL-LYSINEA2OAI0.83
MLYN-DIMETHYL-LYSINEA2ZPM0.83
MLYN-DIMETHYL-LYSINEA,D,G,J,M,S1O190.83
MLYN-DIMETHYL-LYSINEA,D,G,J,P1O1C0.83
MLYN-DIMETHYL-LYSINEA3EPQ0.83
MLYN-DIMETHYL-LYSINEA,D,G,J,M,P1O180.83
MLYN-DIMETHYL-LYSINEA1LLN0.83
MLYN-DIMETHYL-LYSINEA,D,G,P1M8Q0.83
MLYN-DIMETHYL-LYSINEA,B2G9N0.83
MLYN-DIMETHYL-LYSINEA2R580.83
MLYN-DIMETHYL-LYSINEA,B,C,D,E3HSA0.83
MLYN-DIMETHYL-LYSINEA2ETD0.83
MLYN-DIMETHYL-LYSINEB3C0F0.83
MLYN-DIMETHYL-LYSINEA,D,G,J,M,P1MVW0.83
MLYN-DIMETHYL-LYSINEA,B2MYS0.83
MLYN-DIMETHYL-LYSINEA,D,G,J,M,P1O1E0.83
MLYN-DIMETHYL-LYSINEA,B2PQW0.83
MLYN-DIMETHYL-LYSINEA,D,G,J,M,P1O1D0.83
MLYN-DIMETHYL-LYSINEA,B,C,D,E,F,
G,H
3F9X0.83
MLYN-DIMETHYL-LYSINEA,B,C,D2HO30.83
MLYN-DIMETHYL-LYSINEA,B,F,G2Q8D0.83
MLYN-DIMETHYL-LYSINEA,B,C,D3C8G0.83
MLYN-DIMETHYL-LYSINEA,C2W5Z0.83
MLYN-DIMETHYL-LYSINEA,B,C3EGL0.83
MLYN-DIMETHYL-LYSINEA,B2ETV0.83
MLYN-DIMETHYL-LYSINEA,P2RI70.83
MLYN-DIMETHYL-LYSINEA,B1R1G0.83
MLYN-DIMETHYL-LYSINEA,D,G,J1O1F0.83
MLYN-DIMETHYL-LYSINEA,B,C,D1XL30.83
MLYN-DIMETHYL-LYSINEA132L0.83
MLYN-DIMETHYL-LYSINEA3E3X0.83
MLYN-DIMETHYL-LYSINEA,B2VGX0.83
MLYN-DIMETHYL-LYSINEA,D,G,J1O1B0.83
MLYN-DIMETHYL-LYSINEA2FTZ0.83
MLYN-DIMETHYL-LYSINEA,B,C2VIX0.83
MLYN-DIMETHYL-LYSINEB1GUW0.83
MLYN-DIMETHYL-LYSINEA,B2I6G0.83
MLYN-DIMETHYL-LYSINEA,B2Q7X0.83
MLYN-DIMETHYL-LYSINEA,C,P,Q2RJE0.83
MLYN-DIMETHYL-LYSINEA,B,P,Q2RFI0.83
MLYN-DIMETHYL-LYSINEA,C,P,R2VPE0.83
MLYN-DIMETHYL-LYSINEA,B,C,D3HHL0.83
MLYN-DIMETHYL-LYSINEP2CNX0.83
MLYN-DIMETHYL-LYSINEA2VGY0.83
MLYN-DIMETHYL-LYSINEA,B2VJ40.83
MLYN-DIMETHYL-LYSINEA2FCL0.83
MLYN-DIMETHYL-LYSINE2,3,48KME0.83
MLYN-DIMETHYL-LYSINEA,B,C,D2F4I0.83
MLYN-DIMETHYL-LYSINEA,B2PX80.83
MLYN-DIMETHYL-LYSINEA,B2VD90.83
MLYN-DIMETHYL-LYSINEA,B2QJV0.83
MLYN-DIMETHYL-LYSINEA,C,P,R2VPG0.83
MLYN-DIMETHYL-LYSINEA,B3BED0.83
MLYN-DIMETHYL-LYSINEA3GS90.83
MLYN-DIMETHYL-LYSINEA,D,G,J,M,P1O1A0.83
MLYN-DIMETHYL-LYSINEA,B2IG00.83
MLYN-DIMETHYL-LYSINEP1KNA0.83
MLYN-DIMETHYL-LYSINEB2H130.83
MLYN-DIMETHYL-LYSINEA,B,C,D2OX00.83