ligands in co-crystal #195 Output Download CSV

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  The docking scores are in the AutoDock Vina metric.
L: AMP-NSP3
PA_INFB

Docking Scores:
-7.10
Similarity Score:
N/A
Best Match:
N/A

L: S-Adenosylmethionine-NSP16
PA_INFB

Docking Scores:
-6.52
Similarity Score:
N/A
Best Match:
N/A

L: SCHEMBL17719237-RDRP
PA_INFB

Docking Scores:
-7.24
Similarity Score:
N/A
Best Match:
N/A

L: MLN-4760-ACE2
PA_INFB

Docking Scores:
-7.57
Similarity Score:
N/A
Best Match:
N/A

L: GTPL10716-3CLPro
PA_INFB

Docking Scores:
-8.55
Similarity Score:
N/A
Best Match:
N/A

L: AMP-NSP3
PB2_A-H3N2

Docking Scores:
-6.97 -6.70
Similarity Score:
N/A
Best Match:
N/A

L: S-Adenosylmethionine-NSP16
PB2_A-H3N2

Docking Scores:
-6.11 -6.82
Similarity Score:
N/A
Best Match:
N/A

L: SCHEMBL17719237-RDRP
PB2_A-H3N2

Docking Scores:
-6.06 -5.98
Similarity Score:
N/A
Best Match:
N/A

L: MLN-4760-ACE2
PB2_A-H3N2

Docking Scores:
-7.18 -7.55
Similarity Score:
N/A
Best Match:
N/A

L: GTPL10716-3CLPro
PB2_A-H3N2

Docking Scores:
-7.41 -6.52
Similarity Score:
N/A
Best Match:
N/A

L: AMP-NSP3
PB2_A-H5N1

Docking Scores:
-6.98 -6.60 -6.90
Similarity Score:
N/A
Best Match:
N/A

L: S-Adenosylmethionine-NSP16
PB2_A-H5N1

Docking Scores:
-7.15 -5.53 -6.51
Similarity Score:
N/A
Best Match:
N/A

L: SCHEMBL17719237-RDRP
PB2_A-H5N1

Docking Scores:
-6.31 -5.86 -6.10
Similarity Score:
N/A
Best Match:
N/A

L: MLN-4760-ACE2
PB2_A-H5N1

Docking Scores:
-6.81 -6.31 -7.00
Similarity Score:
N/A
Best Match:
N/A

L: GTPL10716-3CLPro
PB2_A-H5N1

Docking Scores:
-6.80 -6.86 -6.76
Similarity Score:
N/A
Best Match:
N/A

L: AMP-NSP3
PB2_INFB

Docking Scores:
-6.68
Similarity Score:
N/A
Best Match:
N/A

L: S-Adenosylmethionine-NSP16
PB2_INFB

Docking Scores:
-7.01
Similarity Score:
N/A
Best Match:
N/A

L: SCHEMBL17719237-RDRP
PB2_INFB

Docking Scores:
-6.83
Similarity Score:
N/A
Best Match:
N/A

L: MLN-4760-ACE2
PB2_INFB

Docking Scores:
-7.42
Similarity Score:
N/A
Best Match:
N/A

L: GTPL10716-3CLPro
PB2_INFB

Docking Scores:
-7.64
Similarity Score:
N/A
Best Match:
N/A