## |
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 |
|
C |
83 |
20 |
14361 |
◊ |
F |
x,y,z-1 |
1_554 |
68 |
19 |
14005 |
616.4 |
-3.3 |
0.720 |
11 |
6 |
0 |
0.011 |
2 |
|
B |
81 |
20 |
14209 |
◊ |
E |
x,y,z-1 |
1_554 |
71 |
20 |
14209 |
609.2 |
-3.9 |
0.682 |
9 |
7 |
0 |
0.011 |
3 |
|
A |
68 |
17 |
14348 |
◊ |
D |
x,y,z-1 |
1_554 |
57 |
18 |
14057 |
488.4 |
-5.4 |
0.491 |
5 |
3 |
0 |
0.011 |
Average: |
571.3 |
-4.2 |
0.631 |
8 |
5 |
0 |
0.011 |
2 |
4 |
|
E |
56 |
15 |
14209 |
◊ |
D |
x,y-1,z |
1_545 |
65 |
18 |
14057 |
603.8 |
-11.8 |
0.064 |
7 |
0 |
0 |
0.316 |
5 |
|
C |
57 |
16 |
14361 |
◊ |
A |
x,y,z |
1_555 |
63 |
18 |
14348 |
587.8 |
-11.2 |
0.064 |
5 |
0 |
0 |
0.316 |
6 |
|
E |
64 |
17 |
14209 |
◊ |
F |
x-1,y,z |
1_455 |
56 |
14 |
14005 |
584.9 |
-11.7 |
0.092 |
6 |
0 |
0 |
0.316 |
7 |
|
B |
62 |
17 |
14209 |
◊ |
A |
x,y,z |
1_555 |
59 |
16 |
14348 |
573.8 |
-11.0 |
0.121 |
6 |
0 |
0 |
0.316 |
8 |
|
C |
61 |
17 |
14361 |
◊ |
B |
x,y,z |
1_555 |
58 |
16 |
14209 |
563.6 |
-10.9 |
0.088 |
6 |
0 |
0 |
0.316 |
9 |
|
D |
50 |
16 |
14057 |
◊ |
F |
x-1,y+1,z |
1_465 |
59 |
16 |
14005 |
550.5 |
-10.7 |
0.091 |
6 |
0 |
0 |
0.316 |
Average: |
577.4 |
-11.2 |
0.086 |
6 |
0 |
0 |
0.316 |
3 |
10 |
|
D |
58 |
17 |
14057 |
◊ |
A |
x,y,z |
1_555 |
56 |
14 |
14348 |
469.6 |
-4.6 |
0.592 |
2 |
0 |
0 |
0.000 |
4 |
11 |
|
[ADP]D:4 |
27 |
1 |
541 |
f |
D |
x,y,z |
1_555 |
52 |
18 |
14057 |
352.1 |
-4.4 |
0.653 |
1 |
0 |
0 |
0.122 |
12 |
|
[ADP]B:2 |
27 |
1 |
546 |
f |
B |
x,y,z |
1_555 |
45 |
18 |
14209 |
348.5 |
-4.5 |
0.586 |
3 |
0 |
0 |
0.122 |
13 |
|
[ADP]A:1 |
27 |
1 |
543 |
f |
A |
x,y,z |
1_555 |
46 |
18 |
14348 |
347.5 |
-4.2 |
0.640 |
3 |
0 |
0 |
0.122 |
14 |
|
[ADP]E:5 |
27 |
1 |
545 |
f |
E |
x,y,z |
1_555 |
50 |
19 |
14209 |
343.6 |
-4.5 |
0.619 |
3 |
0 |
0 |
0.122 |
15 |
|
[ADP]F:6 |
27 |
1 |
546 |
f |
F |
x,y,z |
1_555 |
46 |
19 |
14005 |
343.6 |
-4.5 |
0.636 |
3 |
0 |
0 |
0.122 |
16 |
|
[ADP]C:3 |
27 |
1 |
542 |
f |
C |
x,y,z |
1_555 |
44 |
18 |
14361 |
336.9 |
-4.3 |
0.570 |
3 |
0 |
0 |
0.122 |
Average: |
345.4 |
-4.4 |
0.617 |
3 |
0 |
0 |
0.122 |
5 |
17 |
|
B |
21 |
4 |
14209 |
◊ |
A |
x,y-1,z |
1_545 |
17 |
7 |
14348 |
161.9 |
-1.6 |
0.436 |
1 |
0 |
0 |
0.000 |
18 |
|
B |
17 |
6 |
14209 |
◊ |
C |
x-1,y,z |
1_455 |
20 |
4 |
14361 |
144.8 |
-2.2 |
0.326 |
0 |
0 |
0 |
0.000 |
19 |
|
A |
17 |
4 |
14348 |
◊ |
C |
x-1,y+1,z |
1_465 |
13 |
6 |
14361 |
134.1 |
-2.3 |
0.266 |
0 |
0 |
0 |
0.000 |
Average: |
146.9 |
-2.1 |
0.342 |
0 |
0 |
0 |
0.000 |
6 |
20 |
|
E |
19 |
7 |
14209 |
◊ |
C |
x,y,z |
1_555 |
20 |
7 |
14361 |
151.2 |
-1.1 |
0.549 |
5 |
0 |
0 |
0.000 |
7 |
21 |
|
F |
16 |
4 |
14005 |
◊ |
C |
x,y,z |
1_555 |
15 |
8 |
14361 |
130.2 |
-0.2 |
0.562 |
0 |
0 |
0 |
0.000 |
8 |
22 |
|
E |
12 |
4 |
14209 |
◊ |
A |
x,y,z |
1_555 |
19 |
8 |
14348 |
128.5 |
0.6 |
0.764 |
1 |
0 |
0 |
0.000 |
9 |
23 |
|
B |
10 |
5 |
14209 |
◊ |
F |
x-1,y,z |
1_455 |
14 |
6 |
14005 |
114.1 |
-0.7 |
0.579 |
0 |
0 |
0 |
0.000 |
10 |
24 |
|
F |
10 |
4 |
14005 |
◊ |
E |
x,y,z |
1_555 |
10 |
6 |
14209 |
75.3 |
-0.1 |
0.656 |
0 |
0 |
0 |
0.000 |
25 |
|
F |
8 |
4 |
14005 |
◊ |
D |
x,y,z |
1_555 |
5 |
3 |
14057 |
47.2 |
-0.4 |
0.528 |
0 |
0 |
0 |
0.000 |
26 |
|
E |
6 |
4 |
14209 |
◊ |
D |
x,y,z |
1_555 |
8 |
5 |
14057 |
41.8 |
-0.4 |
0.554 |
0 |
0 |
0 |
0.000 |
Average: |
54.8 |
-0.3 |
0.579 |
0 |
0 |
0 |
0.000 |
11 |
27 |
|
[MG]C:21 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
13 |
5 |
14361 |
51.1 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.125 |
28 |
|
[MG]B:19 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
14209 |
49.9 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.125 |
29 |
|
[MG]A:20 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
14348 |
49.5 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.125 |
Average: |
50.2 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.125 |
12 |
30 |
|
[MG]B:24 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
14348 |
50.6 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.112 |
31 |
|
[MG]C:22 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
17 |
7 |
14209 |
49.6 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.112 |
32 |
|
[MG]D:23 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
13 |
6 |
14057 |
48.2 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.112 |
33 |
|
[MG]A:25 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
11 |
6 |
14361 |
47.4 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.112 |
Average: |
49.0 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.112 |
13 |
34 |
|
[MG]B:10 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
14209 |
42.1 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.119 |
35 |
|
[MG]A:8 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
14348 |
40.7 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.119 |
36 |
|
[MG]E:16 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
9 |
5 |
14209 |
40.6 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.119 |
37 |
|
[MG]D:14 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
9 |
5 |
14057 |
40.1 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.119 |
38 |
|
[MG]F:18 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
8 |
4 |
14005 |
39.9 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.119 |
39 |
|
[MG]C:12 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
11 |
6 |
14361 |
39.2 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.119 |
Average: |
40.4 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.119 |
14 |
40 |
|
[MG]D:13 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
12 |
6 |
14057 |
38.7 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.108 |
41 |
|
[MG]B:9 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
14209 |
36.7 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.108 |
42 |
|
[MG]F:17 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
9 |
5 |
14005 |
36.6 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.108 |
43 |
|
[MG]C:11 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
11 |
6 |
14361 |
36.1 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.108 |
44 |
|
[MG]A:7 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
14348 |
35.8 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.108 |
45 |
|
[MG]E:15 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
9 |
5 |
14209 |
34.9 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.108 |
Average: |
36.5 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.108 |
15 |
46 |
|
[MG]C:11 |
1 |
1 |
98 |
f |
[ADP]C:3 |
x,y,z |
1_555 |
4 |
1 |
542 |
36.0 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.120 |
47 |
|
[MG]F:17 |
1 |
1 |
98 |
f |
[ADP]F:6 |
x,y,z |
1_555 |
4 |
1 |
546 |
34.7 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.120 |
48 |
|
[MG]A:7 |
1 |
1 |
98 |
f |
[ADP]A:1 |
x,y,z |
1_555 |
3 |
1 |
543 |
34.2 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.120 |
49 |
|
[MG]E:15 |
1 |
1 |
98 |
f |
[ADP]E:5 |
x,y,z |
1_555 |
4 |
1 |
545 |
33.9 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.120 |
50 |
|
[MG]D:13 |
1 |
1 |
98 |
f |
[ADP]D:4 |
x,y,z |
1_555 |
6 |
1 |
541 |
33.2 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.120 |
51 |
|
[MG]B:9 |
1 |
1 |
98 |
f |
[ADP]B:2 |
x,y,z |
1_555 |
6 |
1 |
546 |
33.1 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.120 |
Average: |
34.2 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.120 |
16 |
52 |
|
[MG]A:25 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
14348 |
30.4 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.051 |
53 |
|
[MG]B:24 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
14209 |
29.7 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.051 |
54 |
|
[MG]C:22 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
14361 |
29.6 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.051 |
55 |
|
[MG]D:23 |
1 |
1 |
98 |
◊ |
F |
x-1,y+1,z |
1_465 |
3 |
1 |
14005 |
29.4 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.051 |
Average: |
29.7 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.051 |
17 |
56 |
|
[MG]F:18 |
1 |
1 |
98 |
f |
[ADP]F:6 |
x,y,z |
1_555 |
5 |
1 |
546 |
29.4 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.100 |
57 |
|
[MG]E:16 |
1 |
1 |
98 |
f |
[ADP]E:5 |
x,y,z |
1_555 |
4 |
1 |
545 |
29.4 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.100 |
58 |
|
[MG]D:14 |
1 |
1 |
98 |
f |
[ADP]D:4 |
x,y,z |
1_555 |
4 |
1 |
541 |
29.3 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.100 |
59 |
|
[MG]C:12 |
1 |
1 |
98 |
f |
[ADP]C:3 |
x,y,z |
1_555 |
4 |
1 |
542 |
29.3 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.100 |
60 |
|
[MG]A:8 |
1 |
1 |
98 |
f |
[ADP]A:1 |
x,y,z |
1_555 |
5 |
1 |
543 |
28.4 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.100 |
61 |
|
[MG]B:10 |
1 |
1 |
98 |
f |
[ADP]B:2 |
x,y,z |
1_555 |
1 |
1 |
546 |
28.1 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.100 |
Average: |
29.0 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.100 |
18 |
62 |
|
[MG]B:19 |
1 |
1 |
98 |
◊ |
E |
x,y,z-1 |
1_554 |
3 |
2 |
14209 |
21.0 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.003 |
63 |
|
[MG]A:20 |
1 |
1 |
98 |
◊ |
D |
x,y,z-1 |
1_554 |
3 |
2 |
14057 |
19.1 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.003 |
64 |
|
[MG]C:21 |
1 |
1 |
98 |
◊ |
F |
x,y,z-1 |
1_554 |
3 |
2 |
14005 |
18.5 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.003 |
Average: |
19.5 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.003 |
19 |
65 |
|
[MG]A:8 |
1 |
1 |
98 |
f |
[MG]A:7 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.4 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.013 |
20 |
66 |
|
[MG]B:9 |
1 |
1 |
98 |
f |
[MG]B:10 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.9 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.013 |
21 |
67 |
|
[MG]E:16 |
1 |
1 |
98 |
f |
[MG]E:15 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.7 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.016 |
22 |
68 |
|
[MG]F:18 |
1 |
1 |
98 |
f |
[MG]F:17 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.4 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.015 |
23 |
69 |
|
[MG]C:12 |
1 |
1 |
98 |
f |
[MG]C:11 |
x,y,z |
1_555 |
1 |
1 |
98 |
9.9 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.011 |
24 |
70 |
|
[MG]D:14 |
1 |
1 |
98 |
f |
[MG]D:13 |
x,y,z |
1_555 |
1 |
1 |
98 |
9.9 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.015 |
25 |
71 |
|
E |
1 |
1 |
14209 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
14209 |
4.4 |
0.0 |
0.541 |
0 |
0 |
0 |
0.000 |
|