## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
B |
219 |
60 |
12049 |
◊ |
A |
x,y,z |
1_555 |
206 |
60 |
11797 |
1935.7 |
-28.6 |
0.031 |
16 |
2 |
0 |
1.000 |
2 |
|
L |
217 |
59 |
12138 |
◊ |
H |
x,y,z |
1_555 |
200 |
59 |
11817 |
1914.0 |
-25.0 |
0.065 |
16 |
3 |
0 |
1.000 |
Average: |
1924.8 |
-26.8 |
0.048 |
16 |
3 |
0 |
1.000 |
2 |
3 |
|
L |
52 |
15 |
12138 |
◊ |
B |
x,y,z |
1_555 |
53 |
15 |
12049 |
565.6 |
-2.8 |
0.438 |
9 |
12 |
0 |
0.098 |
3 |
4 |
|
H |
55 |
14 |
11817 |
◊ |
A |
x,y,z |
1_555 |
57 |
15 |
11797 |
517.0 |
-9.1 |
0.115 |
7 |
0 |
0 |
0.140 |
4 |
5 |
|
A |
41 |
11 |
11797 |
◊ |
B |
-x-1,y-1/2,-z+2 |
2_447 |
42 |
15 |
12049 |
415.3 |
-0.1 |
0.708 |
8 |
0 |
0 |
0.000 |
6 |
|
H |
41 |
11 |
11817 |
◊ |
L |
-x,y-1/2,-z |
2_545 |
40 |
15 |
12138 |
403.2 |
0.6 |
0.746 |
8 |
0 |
0 |
0.000 |
Average: |
409.3 |
0.2 |
0.727 |
8 |
0 |
0 |
0.000 |
5 |
7 |
|
H |
29 |
8 |
11817 |
◊ |
A |
x,y,z-1 |
1_554 |
28 |
8 |
11797 |
318.6 |
-0.3 |
0.710 |
2 |
0 |
0 |
0.000 |
6 |
8 |
|
B |
27 |
7 |
12049 |
◊ |
H |
x,y,z |
1_555 |
32 |
12 |
11817 |
276.7 |
0.6 |
0.696 |
3 |
3 |
0 |
0.031 |
9 |
|
L |
26 |
6 |
12138 |
◊ |
A |
x,y,z |
1_555 |
33 |
12 |
11797 |
274.8 |
0.7 |
0.720 |
4 |
3 |
0 |
0.031 |
Average: |
275.7 |
0.6 |
0.708 |
4 |
3 |
0 |
0.031 |
7 |
10 |
|
H |
21 |
6 |
11817 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
22 |
8 |
11797 |
166.0 |
-0.9 |
0.604 |
1 |
0 |
0 |
0.000 |
11 |
|
A |
14 |
6 |
11797 |
◊ |
H |
-x-1,y-1/2,-z+1 |
2_446 |
15 |
7 |
11817 |
113.9 |
-1.4 |
0.468 |
0 |
0 |
0 |
0.000 |
Average: |
140.0 |
-1.1 |
0.536 |
1 |
0 |
0 |
0.000 |
8 |
12 |
|
H |
16 |
7 |
11817 |
◊ |
B |
x,y,z-1 |
1_554 |
13 |
7 |
12049 |
144.0 |
0.5 |
0.729 |
1 |
0 |
0 |
0.000 |
13 |
|
L |
11 |
7 |
12138 |
◊ |
A |
x,y,z-1 |
1_554 |
10 |
5 |
11797 |
88.4 |
-0.2 |
0.597 |
1 |
0 |
0 |
0.000 |
Average: |
116.2 |
0.1 |
0.663 |
1 |
0 |
0 |
0.000 |
9 |
14 |
|
A |
15 |
5 |
11797 |
◊ |
L |
x-1,y,z+1 |
1_456 |
20 |
6 |
12138 |
141.1 |
0.7 |
0.736 |
3 |
0 |
0 |
0.000 |
15 |
|
B |
1 |
1 |
12049 |
◊ |
H |
x-1,y,z+1 |
1_456 |
1 |
1 |
11817 |
5.5 |
0.1 |
0.767 |
0 |
0 |
0 |
0.000 |
Average: |
73.3 |
0.4 |
0.752 |
2 |
0 |
0 |
0.000 |
10 |
16 |
|
A |
12 |
4 |
11797 |
◊ |
H |
x-1,y,z+1 |
1_456 |
14 |
4 |
11817 |
139.8 |
-0.1 |
0.675 |
2 |
0 |
0 |
0.000 |
11 |
17 |
|
H |
16 |
6 |
11817 |
◊ |
B |
-x-1,y-1/2,-z+1 |
2_446 |
18 |
7 |
12049 |
133.1 |
0.9 |
0.764 |
2 |
1 |
0 |
0.000 |
18 |
|
A |
14 |
5 |
11797 |
◊ |
L |
-x,y-1/2,-z+1 |
2_546 |
17 |
6 |
12138 |
122.2 |
0.9 |
0.743 |
1 |
1 |
0 |
0.000 |
Average: |
127.6 |
0.9 |
0.753 |
2 |
1 |
0 |
0.000 |
12 |
19 |
|
[EDO]L:301 |
4 |
1 |
186 |
◊ |
L |
x,y,z |
1_555 |
15 |
9 |
12138 |
105.2 |
3.1 |
0.450 |
2 |
0 |
0 |
0.000 |
13 |
20 |
|
[EDO]H:301 |
4 |
1 |
186 |
f |
H |
x,y,z |
1_555 |
14 |
8 |
11817 |
99.0 |
2.8 |
0.506 |
5 |
0 |
0 |
0.000 |
21 |
|
[EDO]A:301 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
11797 |
98.9 |
2.8 |
0.508 |
4 |
0 |
0 |
0.000 |
Average: |
99.0 |
2.8 |
0.507 |
5 |
0 |
0 |
0.000 |
14 |
22 |
|
[EDO]L:302 |
4 |
1 |
184 |
◊ |
L |
x,y,z |
1_555 |
16 |
7 |
12138 |
88.3 |
2.8 |
0.475 |
1 |
0 |
0 |
0.000 |
15 |
23 |
|
H |
7 |
3 |
11817 |
x |
H |
-x,y-1/2,-z |
2_545 |
5 |
2 |
11817 |
50.7 |
0.7 |
0.676 |
1 |
0 |
0 |
0.000 |
24 |
|
A |
5 |
3 |
11797 |
x |
A |
-x-1,y-1/2,-z+2 |
2_447 |
4 |
1 |
11797 |
38.5 |
0.8 |
0.752 |
1 |
0 |
0 |
0.000 |
Average: |
44.6 |
0.7 |
0.714 |
1 |
0 |
0 |
0.000 |
16 |
25 |
|
B |
6 |
5 |
12049 |
◊ |
L |
x-1,y,z+1 |
1_456 |
10 |
6 |
12138 |
46.1 |
2.0 |
0.881 |
0 |
0 |
0 |
0.000 |
17 |
26 |
|
A |
3 |
2 |
11797 |
f |
[EDO]L:302 |
-x,y-1/2,-z+1 |
2_546 |
2 |
1 |
184 |
27.4 |
0.1 |
0.631 |
0 |
0 |
0 |
0.000 |
18 |
27 |
|
[EDO]L:301 |
3 |
1 |
186 |
f |
H |
x,y,z |
1_555 |
3 |
1 |
11817 |
24.8 |
0.8 |
0.904 |
0 |
0 |
0 |
0.000 |
19 |
28 |
|
B |
4 |
2 |
12049 |
x |
B |
-x-1,y-1/2,-z+1 |
2_446 |
1 |
1 |
12049 |
13.9 |
0.5 |
0.762 |
0 |
0 |
0 |
0.000 |
29 |
|
L |
2 |
1 |
12138 |
x |
L |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
12138 |
9.1 |
0.3 |
0.748 |
0 |
0 |
0 |
0.000 |
Average: |
11.5 |
0.4 |
0.755 |
0 |
0 |
0 |
0.000 |
20 |
30 |
|
L |
3 |
1 |
12138 |
x |
L |
-x,y-1/2,-z |
2_545 |
1 |
1 |
12138 |
10.9 |
0.2 |
0.739 |
0 |
0 |
0 |
0.000 |
31 |
|
B |
3 |
1 |
12049 |
x |
B |
-x-1,y-1/2,-z+2 |
2_447 |
1 |
1 |
12049 |
9.5 |
0.2 |
0.724 |
0 |
0 |
0 |
0.000 |
Average: |
10.2 |
0.2 |
0.732 |
0 |
0 |
0 |
0.000 |
|