## |
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 |
84 |
26 |
6413 |
x |
B |
-y,x,z |
3_555 |
71 |
25 |
6413 |
796.9 |
-14.7 |
0.633 |
4 |
6 |
0 |
0.076 |
2 |
|
A |
76 |
25 |
6075 |
x |
A |
-y,x,z |
3_555 |
75 |
23 |
6075 |
777.8 |
-16.1 |
0.657 |
3 |
6 |
0 |
0.076 |
Average: |
787.4 |
-15.4 |
0.645 |
4 |
6 |
0 |
0.076 |
2 |
3 |
|
B |
26 |
10 |
6413 |
◊ |
A |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
26 |
9 |
6075 |
301.0 |
-7.8 |
0.293 |
0 |
0 |
0 |
0.089 |
3 |
4 |
|
B |
29 |
7 |
6413 |
◊ |
A |
-y-1/2,x+1/2,z-1/2 |
7_454 |
31 |
8 |
6075 |
257.4 |
-2.3 |
0.915 |
3 |
3 |
0 |
0.000 |
4 |
5 |
|
B |
19 |
7 |
6413 |
◊ |
A |
-y-1/2,x-1/2,z-1/2 |
7_444 |
17 |
6 |
6075 |
172.9 |
-1.5 |
0.732 |
1 |
0 |
0 |
0.000 |
5 |
6 |
|
[MPD]A:505 |
7 |
1 |
271 |
f |
A |
x,y,z |
1_555 |
27 |
9 |
6075 |
169.0 |
-11.0 |
0.940 |
1 |
0 |
0 |
0.132 |
6 |
7 |
|
[MPD]A:506 |
6 |
1 |
284 |
f |
A |
x,y,z |
1_555 |
24 |
9 |
6075 |
139.1 |
-9.1 |
0.910 |
1 |
0 |
0 |
0.110 |
7 |
8 |
|
B |
12 |
5 |
6413 |
◊ |
A |
-x,-y,z-1 |
2_554 |
13 |
4 |
6075 |
137.5 |
-2.2 |
0.657 |
2 |
0 |
0 |
0.000 |
8 |
9 |
|
[MPD]A:502 |
6 |
1 |
284 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
6075 |
123.2 |
-8.6 |
0.759 |
0 |
0 |
0 |
0.098 |
9 |
10 |
|
[MPD]A:507 |
7 |
1 |
273 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
6075 |
122.6 |
-8.0 |
0.918 |
0 |
0 |
0 |
0.091 |
10 |
11 |
|
[MPD]B:503 |
6 |
1 |
284 |
f |
B |
-y,x,z |
3_555 |
14 |
5 |
6413 |
110.5 |
-7.6 |
0.803 |
0 |
0 |
0 |
0.087 |
11 |
12 |
|
[MPD]B:501 |
5 |
1 |
280 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
6413 |
106.7 |
-7.5 |
0.650 |
0 |
0 |
0 |
0.086 |
12 |
13 |
|
[MPD]B:503 |
7 |
1 |
284 |
◊ |
B |
x,y,z |
1_555 |
14 |
7 |
6413 |
102.7 |
-7.0 |
0.818 |
0 |
0 |
0 |
0.031 |
13 |
14 |
|
[MPD]A:504 |
7 |
1 |
278 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
6075 |
100.4 |
-6.8 |
0.788 |
0 |
0 |
0 |
0.078 |
14 |
15 |
|
B |
13 |
4 |
6413 |
◊ |
[MPD]B:501 |
-y,x,z |
3_555 |
6 |
1 |
280 |
98.9 |
-6.8 |
0.734 |
0 |
0 |
0 |
0.030 |
15 |
16 |
|
B |
11 |
4 |
6413 |
◊ |
[MPD]A:504 |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
7 |
1 |
278 |
98.0 |
-6.1 |
0.817 |
0 |
0 |
0 |
0.070 |
16 |
17 |
|
[MPD]A:502 |
5 |
1 |
284 |
◊ |
A |
-y,x,z |
3_555 |
10 |
3 |
6075 |
82.7 |
-5.6 |
0.725 |
0 |
0 |
0 |
0.017 |
17 |
18 |
|
[K]A:6 |
1 |
1 |
216 |
f |
[K]A:5 |
x,y,z |
1_555 |
1 |
1 |
216 |
68.4 |
-68.4 |
0.000 |
0 |
0 |
0 |
0.053 |
18 |
19 |
|
[K]B:3 |
1 |
1 |
216 |
f |
[K]B:1 |
x,y,z |
1_555 |
1 |
1 |
216 |
61.3 |
-61.3 |
0.000 |
0 |
0 |
0 |
0.067 |
19 |
20 |
|
[K]B:7 |
1 |
1 |
216 |
f |
[K]B:1 |
x,y,z |
1_555 |
1 |
1 |
216 |
61.3 |
-61.3 |
0.000 |
0 |
0 |
0 |
0.067 |
20 |
21 |
|
[K]B:1 |
1 |
1 |
216 |
x |
B |
x,y,z |
1_555 |
11 |
3 |
6413 |
58.3 |
-41.5 |
0.000 |
0 |
0 |
0 |
0.197 |
22 |
|
[K]A:2 |
1 |
1 |
216 |
x |
A |
x,y,z |
1_555 |
10 |
3 |
6075 |
50.8 |
-34.6 |
0.000 |
0 |
0 |
0 |
0.197 |
23 |
|
[K]A:6 |
1 |
1 |
216 |
x |
A |
x,y,z |
1_555 |
8 |
5 |
6075 |
44.9 |
-29.1 |
0.000 |
0 |
0 |
0 |
0.197 |
Average: |
51.4 |
-35.1 |
0.000 |
0 |
0 |
0 |
0.197 |
21 |
24 |
|
[K]B:7 |
1 |
1 |
216 |
x |
B |
x,y,z |
1_555 |
9 |
5 |
6413 |
58.3 |
-38.8 |
0.000 |
0 |
0 |
0 |
0.170 |
25 |
|
[K]A:5 |
1 |
1 |
216 |
x |
A |
x,y,z |
1_555 |
9 |
4 |
6075 |
46.5 |
-30.3 |
0.000 |
0 |
0 |
0 |
0.170 |
Average: |
52.4 |
-34.5 |
0.000 |
0 |
0 |
0 |
0.170 |
22 |
26 |
|
[MPD]A:507 |
5 |
1 |
273 |
◊ |
A |
-y,x,z |
3_555 |
6 |
2 |
6075 |
57.1 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.009 |
23 |
27 |
|
[K]A:4 |
1 |
1 |
216 |
f |
[K]A:2 |
x,y,z |
1_555 |
1 |
1 |
216 |
56.2 |
-56.2 |
0.000 |
0 |
0 |
0 |
0.043 |
24 |
28 |
|
B |
5 |
3 |
6413 |
◊ |
[MPD]A:506 |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
5 |
1 |
284 |
56.0 |
-3.6 |
0.581 |
0 |
0 |
0 |
0.042 |
25 |
29 |
|
[K]A:6 |
1 |
1 |
216 |
f |
[K]A:2 |
x,y,z |
1_555 |
1 |
1 |
216 |
55.2 |
-55.2 |
0.000 |
0 |
0 |
0 |
0.043 |
26 |
30 |
|
[K]A:8 |
1 |
1 |
216 |
f |
[K]A:5 |
x,y,z |
1_555 |
1 |
1 |
216 |
55.1 |
-55.1 |
0.000 |
0 |
0 |
0 |
0.043 |
27 |
31 |
|
[K]A:4 |
1 |
1 |
216 |
x |
A |
x,y,z |
1_555 |
9 |
3 |
6075 |
53.2 |
-37.4 |
0.000 |
0 |
0 |
0 |
0.162 |
32 |
|
[K]B:3 |
1 |
1 |
216 |
x |
B |
x,y,z |
1_555 |
9 |
3 |
6413 |
51.5 |
-36.9 |
0.000 |
0 |
0 |
0 |
0.162 |
Average: |
52.3 |
-37.2 |
0.000 |
0 |
0 |
0 |
0.162 |
28 |
33 |
|
[MPD]A:506 |
3 |
1 |
284 |
f |
[MPD]A:504 |
x,y,z |
1_555 |
4 |
1 |
278 |
53.1 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.058 |
29 |
34 |
|
[MPD]A:507 |
5 |
1 |
273 |
f |
[MPD]A:505 |
x,y,z |
1_555 |
5 |
1 |
271 |
51.9 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.057 |
30 |
35 |
|
B |
6 |
1 |
6413 |
◊ |
A |
x-1/2,y+1/2,z-1/2 |
5_454 |
6 |
2 |
6075 |
51.6 |
1.1 |
0.923 |
0 |
0 |
0 |
0.000 |
31 |
36 |
|
[K]A:8 |
1 |
1 |
216 |
x |
A |
x,y,z |
1_555 |
13 |
5 |
6075 |
47.3 |
-30.6 |
0.000 |
0 |
0 |
0 |
0.095 |
32 |
37 |
|
A |
7 |
2 |
6075 |
◊ |
B |
-y,x,z+1 |
3_556 |
4 |
2 |
6413 |
44.2 |
0.5 |
0.908 |
1 |
1 |
0 |
0.000 |
33 |
38 |
|
[K]B:9 |
1 |
1 |
216 |
x |
B |
x,y,z |
1_555 |
8 |
2 |
6413 |
38.1 |
-22.2 |
0.000 |
0 |
0 |
0 |
0.097 |
34 |
39 |
|
[K]A:5 |
1 |
1 |
216 |
f |
[K]A:2 |
x,y,z |
1_555 |
1 |
1 |
216 |
36.5 |
-36.5 |
0.000 |
0 |
0 |
0 |
0.028 |
35 |
40 |
|
[K]A:8 |
1 |
1 |
216 |
f |
[K]A:6 |
x,y,z |
1_555 |
1 |
1 |
216 |
32.2 |
-32.2 |
0.000 |
0 |
0 |
0 |
0.025 |
36 |
41 |
|
[K]B:9 |
1 |
1 |
216 |
f |
[K]B:3 |
x,y,z |
1_555 |
1 |
1 |
216 |
30.0 |
-30.0 |
0.000 |
0 |
0 |
0 |
0.033 |
37 |
42 |
|
[K]B:7 |
1 |
1 |
216 |
f |
[K]B:3 |
x,y,z |
1_555 |
1 |
1 |
216 |
17.9 |
-17.9 |
0.000 |
0 |
0 |
0 |
0.020 |
38 |
43 |
|
B |
4 |
1 |
6413 |
◊ |
[MPD]A:507 |
x-1/2,y+1/2,z-1/2 |
5_454 |
1 |
1 |
273 |
16.2 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.000 |
39 |
44 |
|
[K]A:6 |
1 |
1 |
216 |
f |
[K]A:4 |
x,y,z |
1_555 |
1 |
1 |
216 |
15.6 |
-15.6 |
0.000 |
0 |
0 |
0 |
0.012 |
40 |
45 |
|
A |
4 |
3 |
6075 |
◊ |
A |
-x,-y,z |
2_555 |
4 |
3 |
6075 |
13.3 |
0.3 |
0.921 |
0 |
0 |
0 |
0.000 |
46 |
|
B |
4 |
3 |
6413 |
◊ |
B |
-x,-y,z |
2_555 |
4 |
3 |
6413 |
12.2 |
0.3 |
0.895 |
0 |
0 |
0 |
0.000 |
Average: |
12.7 |
0.3 |
0.908 |
0 |
0 |
0 |
0.000 |
41 |
47 |
|
B |
2 |
2 |
6413 |
x |
B |
-y-1/2,x+1/2,z-1/2 |
7_454 |
3 |
2 |
6413 |
7.6 |
-0.1 |
0.690 |
0 |
0 |
0 |
0.000 |
42 |
48 |
|
A |
1 |
1 |
6075 |
◊ |
[MPD]A:506 |
-y,x,z |
3_555 |
1 |
1 |
284 |
4.8 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
|