| ## |
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 |
|
G |
97 |
30 |
9737 |
◊ |
F |
x,y,z |
1_555 |
98 |
32 |
9799 |
943.7 |
-14.0 |
0.050 |
12 |
0 |
0 |
0.346 |
2 |
|
H |
96 |
32 |
9728 |
◊ |
E |
x,y,z |
1_555 |
98 |
33 |
9820 |
933.7 |
-14.5 |
0.039 |
12 |
0 |
0 |
0.346 |
3 |
|
D |
98 |
31 |
9749 |
◊ |
A |
x,y,z |
1_555 |
97 |
30 |
9836 |
928.6 |
-13.9 |
0.053 |
11 |
0 |
0 |
0.346 |
4 |
|
C |
92 |
30 |
9769 |
◊ |
B |
x,y,z |
1_555 |
95 |
31 |
9758 |
922.6 |
-13.8 |
0.046 |
12 |
0 |
0 |
0.346 |
| Average: |
932.1 |
-14.1 |
0.047 |
12 |
0 |
0 |
0.346 |
| 2 |
5 |
|
F |
71 |
23 |
9799 |
◊ |
E |
x,y,z |
1_555 |
76 |
24 |
9820 |
640.8 |
-3.4 |
0.531 |
6 |
0 |
0 |
0.000 |
6 |
|
B |
78 |
24 |
9758 |
◊ |
A |
x,y,z |
1_555 |
75 |
24 |
9836 |
632.8 |
-4.2 |
0.478 |
6 |
0 |
0 |
0.000 |
| Average: |
636.8 |
-3.8 |
0.504 |
6 |
0 |
0 |
0.000 |
| 3 |
7 |
|
H |
49 |
18 |
9728 |
◊ |
G |
x,y,z |
1_555 |
48 |
17 |
9737 |
554.5 |
3.4 |
0.915 |
11 |
7 |
0 |
0.000 |
8 |
|
D |
52 |
18 |
9749 |
◊ |
C |
x,y,z |
1_555 |
51 |
18 |
9769 |
550.2 |
2.5 |
0.891 |
9 |
7 |
0 |
0.000 |
| Average: |
552.3 |
3.0 |
0.903 |
10 |
7 |
0 |
0.000 |
| 4 |
9 |
|
F |
44 |
17 |
9799 |
◊ |
H |
x,y,z-1 |
1_554 |
40 |
13 |
9728 |
377.4 |
1.1 |
0.675 |
8 |
0 |
0 |
0.000 |
| 5 |
10 |
|
C |
39 |
15 |
9769 |
◊ |
E |
-x,y-1/2,-z+1 |
2_546 |
39 |
15 |
9820 |
374.3 |
-2.9 |
0.400 |
1 |
0 |
0 |
0.000 |
11 |
|
A |
35 |
14 |
9836 |
◊ |
G |
-x,y-1/2,-z+1 |
2_546 |
35 |
13 |
9737 |
361.8 |
-2.9 |
0.367 |
3 |
0 |
0 |
0.000 |
| Average: |
368.1 |
-2.9 |
0.383 |
2 |
0 |
0 |
0.000 |
| 6 |
12 |
|
E |
43 |
13 |
9820 |
◊ |
G |
-x,y-1/2,-z+1 |
2_546 |
36 |
12 |
9737 |
298.7 |
1.6 |
0.850 |
1 |
8 |
0 |
0.000 |
13 |
|
C |
30 |
11 |
9769 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
42 |
12 |
9836 |
285.3 |
1.5 |
0.833 |
1 |
3 |
0 |
0.000 |
| Average: |
292.0 |
1.6 |
0.841 |
1 |
6 |
0 |
0.000 |
| 7 |
14 |
|
E |
31 |
9 |
9820 |
◊ |
B |
x-1,y,z |
1_455 |
31 |
8 |
9758 |
286.0 |
-2.4 |
0.403 |
2 |
0 |
0 |
0.000 |
15 |
|
F |
33 |
9 |
9799 |
◊ |
A |
x,y,z |
1_555 |
31 |
9 |
9836 |
278.9 |
-2.2 |
0.439 |
2 |
0 |
0 |
0.000 |
| Average: |
282.5 |
-2.3 |
0.421 |
2 |
0 |
0 |
0.000 |
| 8 |
16 |
|
A |
15 |
7 |
9836 |
◊ |
H |
x,y,z-1 |
1_554 |
15 |
8 |
9728 |
132.6 |
0.6 |
0.668 |
1 |
0 |
0 |
0.000 |
| 9 |
17 |
|
D |
10 |
4 |
9749 |
◊ |
G |
-x,y-1/2,-z |
2_545 |
10 |
4 |
9737 |
105.5 |
-0.5 |
0.500 |
1 |
0 |
0 |
0.000 |
| 10 |
18 |
|
[MN]C:3238 |
1 |
1 |
123 |
f |
C |
x,y,z |
1_555 |
15 |
9 |
9769 |
61.8 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.217 |
19 |
|
[MN]H:8238 |
1 |
1 |
123 |
f |
H |
x,y,z |
1_555 |
9 |
7 |
9728 |
61.4 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.217 |
20 |
|
[MN]E:5238 |
1 |
1 |
123 |
f |
E |
x,y,z |
1_555 |
12 |
7 |
9820 |
60.8 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.217 |
21 |
|
[MN]D:4238 |
1 |
1 |
123 |
f |
D |
x,y,z |
1_555 |
11 |
7 |
9749 |
60.8 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.217 |
22 |
|
[MN]F:6238 |
1 |
1 |
123 |
f |
F |
x,y,z |
1_555 |
12 |
7 |
9799 |
60.6 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.217 |
23 |
|
[MN]G:7238 |
1 |
1 |
123 |
f |
G |
x,y,z |
1_555 |
11 |
7 |
9737 |
60.2 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.217 |
24 |
|
[MN]A:1238 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
10 |
7 |
9836 |
60.0 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.217 |
25 |
|
[MN]B:2238 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
9758 |
59.5 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.217 |
| Average: |
60.6 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.217 |
| 11 |
26 |
|
B |
3 |
1 |
9758 |
◊ |
H |
-x+1,y-1/2,-z+2 |
2_647 |
6 |
2 |
9728 |
55.4 |
-0.7 |
0.165 |
0 |
0 |
0 |
0.000 |
| 12 |
27 |
|
H |
7 |
2 |
9728 |
◊ |
F |
x,y,z |
1_555 |
5 |
2 |
9799 |
47.7 |
0.6 |
0.801 |
0 |
0 |
0 |
0.000 |
28 |
|
C |
8 |
2 |
9769 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
9836 |
46.2 |
0.6 |
0.796 |
1 |
0 |
0 |
0.000 |
29 |
|
D |
7 |
2 |
9749 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
9758 |
43.6 |
0.5 |
0.785 |
0 |
0 |
0 |
0.000 |
30 |
|
G |
6 |
2 |
9737 |
◊ |
E |
x,y,z |
1_555 |
4 |
2 |
9820 |
38.7 |
0.5 |
0.784 |
1 |
0 |
0 |
0.000 |
| Average: |
44.0 |
0.6 |
0.792 |
1 |
0 |
0 |
0.000 |
| 13 |
31 |
|
[CA]G:7237 |
1 |
1 |
85 |
f |
G |
x,y,z |
1_555 |
14 |
7 |
9737 |
47.2 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.401 |
32 |
|
[CA]D:4237 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
15 |
7 |
9749 |
46.3 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.401 |
33 |
|
[CA]B:2237 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
9758 |
45.2 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.401 |
34 |
|
[CA]E:5237 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
12 |
7 |
9820 |
44.7 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.401 |
35 |
|
[CA]A:1237 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
13 |
8 |
9836 |
44.7 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.401 |
36 |
|
[CA]C:3237 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
12 |
6 |
9769 |
43.9 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.401 |
37 |
|
[CA]F:6237 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
10 |
6 |
9799 |
43.8 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.401 |
38 |
|
[CA]H:8237 |
1 |
1 |
85 |
f |
H |
x,y,z |
1_555 |
14 |
8 |
9728 |
43.8 |
-11.7 |
0.000 |
0 |
0 |
0 |
0.401 |
| Average: |
45.0 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.401 |
| 14 |
39 |
|
A |
2 |
1 |
9836 |
◊ |
E |
x,y,z-1 |
1_554 |
3 |
1 |
9820 |
21.2 |
-0.7 |
0.214 |
0 |
0 |
0 |
0.000 |
| 15 |
40 |
|
C |
1 |
1 |
9769 |
◊ |
F |
-x,y-1/2,-z+1 |
2_546 |
5 |
1 |
9799 |
16.4 |
-0.3 |
0.271 |
0 |
0 |
0 |
0.000 |
41 |
|
B |
3 |
1 |
9758 |
◊ |
G |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
9737 |
7.6 |
-0.2 |
0.338 |
0 |
0 |
0 |
0.000 |
| Average: |
12.0 |
-0.2 |
0.305 |
0 |
0 |
0 |
0.000 |
| 16 |
42 |
|
[MN]C:3238 |
1 |
1 |
123 |
f |
[CA]C:3237 |
x,y,z |
1_555 |
1 |
1 |
85 |
10.2 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.035 |
| 17 |
43 |
|
[MN]B:2238 |
1 |
1 |
123 |
f |
[CA]B:2237 |
x,y,z |
1_555 |
1 |
1 |
85 |
10.0 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.035 |
| 18 |
44 |
|
[MN]D:4238 |
1 |
1 |
123 |
f |
[CA]D:4237 |
x,y,z |
1_555 |
1 |
1 |
85 |
9.9 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.035 |
| 19 |
45 |
|
[MN]A:1238 |
1 |
1 |
123 |
f |
[CA]A:1237 |
x,y,z |
1_555 |
1 |
1 |
85 |
9.4 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.034 |
| 20 |
46 |
|
[MN]E:5238 |
1 |
1 |
123 |
f |
[CA]E:5237 |
x,y,z |
1_555 |
1 |
1 |
85 |
9.2 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.032 |
| 21 |
47 |
|
[MN]F:6238 |
1 |
1 |
123 |
f |
[CA]F:6237 |
x,y,z |
1_555 |
1 |
1 |
85 |
9.1 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.032 |
| 22 |
48 |
|
[MN]G:7238 |
1 |
1 |
123 |
f |
[CA]G:7237 |
x,y,z |
1_555 |
1 |
1 |
85 |
8.9 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.031 |
| 23 |
49 |
|
[MN]H:8238 |
1 |
1 |
123 |
f |
[CA]H:8237 |
x,y,z |
1_555 |
1 |
1 |
85 |
7.1 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.024 |
| 24 |
50 |
|
D |
2 |
1 |
9749 |
◊ |
E |
x,y,z-1 |
1_554 |
3 |
2 |
9820 |
5.9 |
0.2 |
0.743 |
0 |
0 |
0 |
0.000 |
|