Name of Query Ligand: HN3_A_1049_tran
Name of Template Ligand: 2SK_A_5009
Atom Number of Query Ligand: 46
Atom Number of Template Ligand: 38
Rigid LS-align Results
-
PC-score:
PC-score = 0.5704 P-value = 0.023042 (if normalized by atom number of Query Ligand)
PC-score = 0.6971 P-value = 0.003168 (if normalized by atom number of Template Ligand)
(You should use PC-score normalized by the atom number of the reference ligand)
-
Jaccard Ratio: 0.2903
-
RMSDLS: 1.5161
-
Alignment Information:
(":" denotes aligned atom pairs of d < 1.0 A, "." denotes other aligned atoms)
Query Atom Index: |
|
5 |
7 |
10 |
11 |
12 |
13 |
18 |
20 |
22 |
Query Atom Type: |
|
N |
C |
C |
C |
C |
C |
C |
C |
C |
Aligned Tag: |
|
: |
: |
: |
: |
: |
: |
: |
: |
: |
Templ Atom Type: |
|
C |
C |
C |
C |
C |
C |
C |
C |
C |
Templ Atom Index: |
|
13 |
14 |
10 |
9 |
12 |
11 |
7 |
8 |
18 |
|
Visualization (Query ligand in yellow and template ligand in red)
|