| ## |
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 |
|
F |
52 |
8 |
1349 |
◊ |
C |
x,y,z |
1_555 |
76 |
20 |
7842 |
541.7 |
-10.3 |
0.344 |
2 |
0 |
0 |
0.908 |
2 |
|
E |
49 |
8 |
1357 |
◊ |
B |
x,y,z |
1_555 |
78 |
19 |
7874 |
539.1 |
-9.4 |
0.384 |
3 |
0 |
0 |
0.908 |
3 |
|
D |
47 |
8 |
1353 |
◊ |
A |
x,y,z |
1_555 |
71 |
19 |
7826 |
512.3 |
-9.0 |
0.384 |
2 |
0 |
0 |
0.908 |
| Average: |
531.0 |
-9.5 |
0.371 |
2 |
0 |
0 |
0.908 |
| 2 |
4 |
|
A |
41 |
12 |
7826 |
x |
A |
x-1,y,z |
1_455 |
41 |
12 |
7826 |
437.0 |
-3.2 |
0.479 |
10 |
7 |
0 |
0.000 |
5 |
|
C |
42 |
12 |
7842 |
x |
C |
x-1,y,z |
1_455 |
43 |
12 |
7842 |
436.9 |
-3.1 |
0.520 |
8 |
8 |
0 |
0.000 |
6 |
|
B |
41 |
12 |
7874 |
x |
B |
x-1,y,z |
1_455 |
39 |
12 |
7874 |
431.7 |
-3.1 |
0.479 |
9 |
7 |
0 |
0.000 |
| Average: |
435.2 |
-3.1 |
0.492 |
9 |
7 |
0 |
0.000 |
| 3 |
7 |
|
D |
38 |
8 |
1353 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
49 |
11 |
7874 |
408.3 |
-4.7 |
0.494 |
9 |
4 |
0 |
0.896 |
8 |
|
E |
36 |
8 |
1357 |
◊ |
C |
x,y,z-1 |
1_554 |
47 |
10 |
7842 |
377.4 |
-4.0 |
0.582 |
9 |
4 |
0 |
0.896 |
| Average: |
392.8 |
-4.4 |
0.538 |
9 |
4 |
0 |
0.896 |
| 4 |
9 |
|
A |
40 |
11 |
7826 |
◊ |
C |
-x+1,y-1/2,-z+2 |
2_647 |
42 |
13 |
7842 |
395.2 |
-5.6 |
0.223 |
1 |
0 |
0 |
0.000 |
10 |
|
B |
38 |
14 |
7874 |
◊ |
C |
x,y,z-1 |
1_554 |
37 |
11 |
7842 |
390.3 |
-5.3 |
0.260 |
2 |
1 |
0 |
0.000 |
11 |
|
A |
31 |
10 |
7826 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
36 |
10 |
7874 |
354.2 |
-5.0 |
0.240 |
2 |
1 |
0 |
0.000 |
| Average: |
379.9 |
-5.3 |
0.241 |
2 |
1 |
0 |
0.000 |
| 5 |
12 |
|
A |
49 |
10 |
7826 |
◊ |
F |
-x+1,y-1/2,-z+2 |
2_647 |
38 |
8 |
1349 |
386.0 |
-4.0 |
0.529 |
9 |
3 |
0 |
0.225 |
| 6 |
13 |
|
B |
44 |
14 |
7874 |
◊ |
A |
x,y,z |
1_555 |
41 |
12 |
7826 |
367.0 |
-1.4 |
0.674 |
6 |
8 |
0 |
0.098 |
| 7 |
14 |
|
A |
22 |
6 |
7826 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
21 |
7 |
7842 |
204.2 |
-0.5 |
0.631 |
1 |
2 |
0 |
0.000 |
| 8 |
15 |
|
C |
12 |
6 |
7842 |
◊ |
B |
x,y,z |
1_555 |
20 |
8 |
7874 |
161.3 |
-2.6 |
0.318 |
1 |
0 |
0 |
0.000 |
| 9 |
16 |
|
[ACT]B:202 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
21 |
8 |
7874 |
117.6 |
-0.3 |
0.708 |
0 |
0 |
0 |
0.025 |
| 10 |
17 |
|
[ACT]C:202 |
4 |
1 |
182 |
f |
C |
x,y,z |
1_555 |
16 |
7 |
7842 |
105.0 |
-1.0 |
0.589 |
2 |
0 |
0 |
0.079 |
| 11 |
18 |
|
[ACT]A:202 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
7826 |
93.6 |
-0.4 |
0.708 |
1 |
0 |
0 |
0.023 |
| 12 |
19 |
|
[ACT]B:201 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
7874 |
78.6 |
-0.4 |
0.680 |
1 |
0 |
0 |
0.079 |
| 13 |
20 |
|
A |
6 |
2 |
7826 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
8 |
2 |
7842 |
52.2 |
-0.1 |
0.641 |
0 |
1 |
0 |
0.000 |
| 14 |
21 |
|
A |
7 |
4 |
7826 |
f |
[CL]A:204 |
x-1,y,z |
1_455 |
1 |
1 |
125 |
51.4 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.242 |
| 15 |
22 |
|
[CA]A:201 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
7826 |
51.3 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.287 |
| 16 |
23 |
|
A |
11 |
7 |
7826 |
f |
[CL]C:201 |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
125 |
49.0 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.171 |
| 17 |
24 |
|
[CA]C:204 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
8 |
5 |
7842 |
41.6 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.497 |
| 18 |
25 |
|
[CL]A:204 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
7826 |
38.1 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 19 |
26 |
|
[CL]C:201 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
6 |
3 |
7842 |
35.2 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| 20 |
27 |
|
B |
8 |
4 |
7874 |
◊ |
F |
x-1,y,z-1 |
1_454 |
4 |
2 |
1349 |
34.5 |
-0.4 |
0.588 |
0 |
0 |
0 |
0.000 |
28 |
|
D |
3 |
2 |
1353 |
◊ |
C |
-x,y-1/2,-z+2 |
2_547 |
7 |
4 |
7842 |
26.1 |
-0.3 |
0.606 |
0 |
0 |
0 |
0.000 |
29 |
|
A |
6 |
4 |
7826 |
◊ |
E |
-x+1,y-1/2,-z+1 |
2_646 |
3 |
2 |
1357 |
22.2 |
-0.3 |
0.601 |
0 |
0 |
0 |
0.000 |
| Average: |
27.6 |
-0.3 |
0.598 |
0 |
0 |
0 |
0.000 |
| 21 |
30 |
|
B |
3 |
1 |
7874 |
◊ |
C |
x-1,y,z-1 |
1_454 |
4 |
2 |
7842 |
33.1 |
0.5 |
0.501 |
0 |
0 |
0 |
0.000 |
31 |
|
A |
2 |
1 |
7826 |
◊ |
C |
-x,y-1/2,-z+2 |
2_547 |
3 |
1 |
7842 |
26.6 |
0.5 |
0.547 |
0 |
0 |
0 |
0.000 |
32 |
|
A |
2 |
1 |
7826 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
1 |
7874 |
26.5 |
0.7 |
0.503 |
0 |
0 |
0 |
0.000 |
| Average: |
28.7 |
0.6 |
0.517 |
0 |
0 |
0 |
0.000 |
| 22 |
33 |
|
B |
3 |
1 |
7874 |
◊ |
C |
x-1,y,z |
1_455 |
2 |
1 |
7842 |
32.5 |
1.5 |
0.900 |
1 |
2 |
0 |
0.000 |
| 23 |
34 |
|
[CL]F:301 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
6 |
2 |
1349 |
28.6 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.109 |
| 24 |
35 |
|
[ACT]B:201 |
4 |
1 |
183 |
◊ |
C |
x,y,z-1 |
1_554 |
3 |
1 |
7842 |
24.4 |
-0.6 |
0.453 |
0 |
0 |
0 |
0.000 |
| 25 |
36 |
|
[ACT]B:201 |
2 |
1 |
183 |
◊ |
F |
x,y,z-1 |
1_554 |
3 |
1 |
1349 |
13.3 |
-0.1 |
0.743 |
0 |
0 |
0 |
0.000 |
| 26 |
37 |
|
[MG]C:203 |
1 |
1 |
98 |
f |
C |
x-1,y,z |
1_455 |
1 |
1 |
7842 |
12.9 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.068 |
| 27 |
38 |
|
B |
1 |
1 |
7874 |
◊ |
[CL]C:201 |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
125 |
10.0 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.016 |
| 28 |
39 |
|
[CL]F:301 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
7842 |
8.5 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.033 |
| 29 |
40 |
|
[ACT]B:202 |
2 |
1 |
182 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
1 |
7874 |
8.4 |
0.1 |
0.733 |
0 |
0 |
0 |
0.000 |
| 30 |
41 |
|
B |
1 |
1 |
7874 |
◊ |
E |
x-1,y,z |
1_455 |
2 |
1 |
1357 |
7.8 |
-0.0 |
0.680 |
0 |
0 |
0 |
0.000 |
| 31 |
42 |
|
[MG]C:203 |
1 |
1 |
98 |
◊ |
[CA]C:204 |
x,y,z |
1_555 |
1 |
1 |
85 |
4.9 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.000 |
| 32 |
43 |
|
B |
1 |
1 |
7874 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
7842 |
3.6 |
-0.1 |
0.412 |
0 |
0 |
0 |
0.000 |
| 33 |
44 |
|
B |
1 |
1 |
7874 |
◊ |
[ACT]B:201 |
x-1,y,z |
1_455 |
1 |
1 |
183 |
1.5 |
0.0 |
0.609 |
0 |
0 |
0 |
0.000 |
| 34 |
45 |
|
C |
1 |
1 |
7842 |
◊ |
F |
x-1,y,z |
1_455 |
1 |
1 |
1349 |
1.2 |
0.0 |
0.702 |
0 |
0 |
0 |
0.000 |
| 35 |
46 |
|
A |
1 |
1 |
7826 |
◊ |
[ACT]B:201 |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
183 |
0.7 |
0.0 |
0.589 |
0 |
0 |
0 |
0.000 |
|