## |
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 |
153 |
46 |
19371 |
◊ |
A |
x,y,z |
1_555 |
150 |
45 |
18567 |
1376.3 |
-17.8 |
0.041 |
16 |
0 |
0 |
0.126 |
2 |
|
D |
142 |
45 |
18992 |
◊ |
C |
x,y,z |
1_555 |
152 |
47 |
18886 |
1363.9 |
-16.1 |
0.063 |
16 |
0 |
0 |
0.126 |
Average: |
1370.1 |
-16.9 |
0.052 |
16 |
0 |
0 |
0.126 |
2 |
3 |
|
C |
138 |
37 |
18886 |
◊ |
A |
x-1,y,z |
1_455 |
146 |
37 |
18567 |
1181.2 |
-5.4 |
0.490 |
6 |
0 |
0 |
0.000 |
3 |
4 |
|
C |
97 |
28 |
18886 |
◊ |
B |
x,y,z |
1_555 |
104 |
33 |
19371 |
865.3 |
-6.2 |
0.307 |
4 |
4 |
0 |
0.043 |
5 |
|
D |
77 |
24 |
18992 |
◊ |
A |
x,y,z |
1_555 |
79 |
25 |
18567 |
727.9 |
-6.9 |
0.224 |
4 |
0 |
0 |
0.043 |
Average: |
796.6 |
-6.5 |
0.266 |
4 |
2 |
0 |
0.043 |
4 |
6 |
|
[ADQ]B:506 |
36 |
1 |
731 |
f |
B |
x,y,z |
1_555 |
76 |
34 |
19371 |
535.5 |
-5.4 |
0.610 |
11 |
0 |
0 |
0.052 |
5 |
7 |
|
[ADP]A:557 |
25 |
1 |
577 |
f |
A |
x,y,z |
1_555 |
55 |
22 |
18567 |
340.3 |
-5.9 |
0.520 |
8 |
0 |
0 |
0.045 |
8 |
|
[ADP]C:558 |
25 |
1 |
548 |
f |
C |
x,y,z |
1_555 |
55 |
23 |
18886 |
318.2 |
-3.9 |
0.572 |
8 |
0 |
0 |
0.045 |
Average: |
329.3 |
-4.9 |
0.546 |
8 |
0 |
0 |
0.045 |
6 |
9 |
|
B |
30 |
9 |
19371 |
◊ |
D |
x-1,y,z-1 |
1_454 |
33 |
10 |
18992 |
255.6 |
-1.4 |
0.379 |
6 |
0 |
0 |
0.000 |
7 |
10 |
|
D |
34 |
12 |
18992 |
◊ |
B |
x,y,z |
1_555 |
25 |
12 |
19371 |
252.4 |
0.6 |
0.687 |
3 |
0 |
1 |
0.011 |
8 |
11 |
|
C |
26 |
10 |
18886 |
◊ |
B |
-x+1,y-1/2,-z+2 |
2_647 |
26 |
10 |
19371 |
238.2 |
1.2 |
0.740 |
0 |
3 |
0 |
0.000 |
9 |
12 |
|
D |
26 |
8 |
18992 |
◊ |
B |
-x+1,y-1/2,-z+2 |
2_647 |
18 |
6 |
19371 |
221.6 |
0.1 |
0.557 |
2 |
0 |
0 |
0.000 |
10 |
13 |
|
C |
24 |
7 |
18886 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
24 |
10 |
19371 |
210.5 |
0.6 |
0.658 |
1 |
3 |
0 |
0.000 |
11 |
14 |
|
A |
25 |
8 |
18567 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
22 |
6 |
19371 |
199.2 |
0.8 |
0.718 |
4 |
3 |
0 |
0.000 |
12 |
15 |
|
D |
17 |
6 |
18992 |
◊ |
A |
-x+2,y-1/2,-z+2 |
2_747 |
18 |
5 |
18567 |
152.0 |
-1.4 |
0.387 |
1 |
0 |
0 |
0.000 |
13 |
16 |
|
B |
19 |
6 |
19371 |
◊ |
C |
x,y,z-1 |
1_554 |
17 |
7 |
18886 |
133.6 |
0.4 |
0.671 |
2 |
0 |
0 |
0.000 |
14 |
17 |
|
[SO4]C:1010 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
23 |
10 |
18886 |
126.5 |
-18.2 |
0.787 |
5 |
0 |
0 |
0.111 |
15 |
18 |
|
[SO4]D:1011 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
24 |
10 |
18992 |
119.5 |
-18.2 |
0.801 |
6 |
0 |
0 |
0.113 |
16 |
19 |
|
[SO4]A:1008 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
19 |
10 |
18567 |
118.5 |
-19.2 |
0.773 |
10 |
0 |
0 |
0.111 |
17 |
20 |
|
[SO4]D:1003 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
15 |
7 |
18992 |
117.2 |
-18.4 |
0.828 |
6 |
0 |
0 |
0.115 |
18 |
21 |
|
[SO4]B:1001 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
15 |
8 |
19371 |
114.6 |
-18.6 |
0.830 |
7 |
0 |
0 |
0.109 |
19 |
22 |
|
[SO4]B:1021 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
20 |
7 |
19371 |
113.7 |
-16.3 |
0.695 |
9 |
0 |
0 |
0.102 |
20 |
23 |
|
[SO4]B:1009 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
20 |
8 |
19371 |
111.0 |
-15.3 |
0.834 |
6 |
0 |
0 |
0.091 |
21 |
24 |
|
[SO4]A:1000 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
18567 |
108.8 |
-20.5 |
0.677 |
8 |
0 |
0 |
0.113 |
22 |
25 |
|
[SO4]C:1002 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
14 |
6 |
18886 |
107.2 |
-19.5 |
0.745 |
6 |
0 |
0 |
0.120 |
23 |
26 |
|
A |
15 |
7 |
18567 |
◊ |
D |
-x+2,y-1/2,-z+2 |
2_747 |
9 |
4 |
18992 |
101.9 |
-0.1 |
0.591 |
0 |
0 |
0 |
0.000 |
24 |
27 |
|
[SO4]D:1023 |
5 |
1 |
187 |
f |
D |
x,y,z |
1_555 |
12 |
7 |
18992 |
100.6 |
-15.4 |
0.679 |
4 |
0 |
0 |
0.093 |
25 |
28 |
|
[SO4]B:1006 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
19371 |
100.1 |
-14.0 |
0.905 |
3 |
0 |
0 |
0.077 |
26 |
29 |
|
[SO4]A:1020 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
18567 |
97.3 |
-15.3 |
0.815 |
7 |
0 |
0 |
0.087 |
27 |
30 |
|
[SO4]C:1022 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
17 |
8 |
18886 |
96.8 |
-14.8 |
0.827 |
6 |
0 |
0 |
0.095 |
28 |
31 |
|
C |
9 |
3 |
18886 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
18567 |
91.9 |
-2.7 |
0.071 |
0 |
0 |
0 |
0.006 |
29 |
32 |
|
[SO4]D:1004 |
5 |
1 |
188 |
f |
D |
x,y,z |
1_555 |
12 |
5 |
18992 |
90.7 |
-11.5 |
0.936 |
5 |
0 |
0 |
0.075 |
30 |
33 |
|
[SO4]A:1007 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
18567 |
89.0 |
-11.5 |
0.947 |
6 |
0 |
0 |
0.067 |
31 |
34 |
|
[SO4]C:1005 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
9 |
4 |
18886 |
83.3 |
-11.6 |
0.926 |
4 |
0 |
0 |
0.073 |
32 |
35 |
|
B |
9 |
3 |
19371 |
◊ |
A |
x-1,y,z |
1_455 |
9 |
3 |
18567 |
79.2 |
0.9 |
0.776 |
0 |
0 |
0 |
0.000 |
36 |
|
C |
5 |
3 |
18886 |
◊ |
D |
x-1,y,z |
1_455 |
4 |
3 |
18992 |
23.6 |
0.5 |
0.762 |
0 |
0 |
0 |
0.000 |
Average: |
51.4 |
0.7 |
0.769 |
0 |
0 |
0 |
0.000 |
33 |
37 |
|
A |
10 |
6 |
18567 |
◊ |
D |
x,y,z-1 |
1_554 |
5 |
4 |
18992 |
69.8 |
3.1 |
0.945 |
0 |
0 |
0 |
0.000 |
34 |
38 |
|
C |
6 |
2 |
18886 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
8 |
3 |
18567 |
61.3 |
-0.7 |
0.394 |
0 |
0 |
0 |
0.000 |
35 |
39 |
|
[SO4]C:1005 |
4 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
19371 |
46.6 |
-5.8 |
0.770 |
1 |
0 |
0 |
0.031 |
36 |
40 |
|
[ADP]A:557 |
6 |
1 |
577 |
f |
[SO4]A:1020 |
x,y,z |
1_555 |
4 |
1 |
186 |
41.2 |
-4.8 |
0.839 |
0 |
0 |
0 |
0.023 |
37 |
41 |
|
[SO4]B:1006 |
3 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
18886 |
40.1 |
-3.7 |
0.970 |
2 |
0 |
0 |
0.023 |
38 |
42 |
|
[ADP]C:558 |
8 |
1 |
548 |
f |
[SO4]C:1022 |
x,y,z |
1_555 |
4 |
1 |
186 |
39.4 |
-4.9 |
0.860 |
0 |
0 |
0 |
0.026 |
39 |
43 |
|
[ADQ]B:506 |
6 |
1 |
731 |
f |
[SO4]B:1021 |
x,y,z |
1_555 |
4 |
1 |
186 |
36.1 |
-4.7 |
0.806 |
0 |
0 |
0 |
0.024 |
40 |
44 |
|
[SO4]A:1007 |
3 |
1 |
186 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
18992 |
24.4 |
-3.2 |
0.470 |
0 |
0 |
0 |
0.007 |
41 |
45 |
|
C |
2 |
1 |
18886 |
◊ |
D |
-x+1,y-1/2,-z+2 |
2_647 |
1 |
1 |
18992 |
14.4 |
0.3 |
0.769 |
0 |
0 |
0 |
0.000 |
42 |
46 |
|
[SO4]D:1004 |
3 |
1 |
188 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
18567 |
7.7 |
-0.7 |
0.850 |
0 |
0 |
0 |
0.002 |
43 |
47 |
|
[SO4]C:1010 |
1 |
1 |
185 |
f |
[SO4]C:1002 |
x,y,z |
1_555 |
1 |
1 |
185 |
7.4 |
-1.8 |
0.800 |
0 |
0 |
0 |
0.010 |
44 |
48 |
|
[SO4]A:1008 |
1 |
1 |
186 |
f |
[SO4]A:1000 |
x,y,z |
1_555 |
1 |
1 |
186 |
6.3 |
-1.5 |
0.800 |
0 |
0 |
0 |
0.007 |
45 |
49 |
|
[SO4]B:1009 |
1 |
1 |
185 |
f |
[SO4]B:1001 |
x,y,z |
1_555 |
1 |
1 |
186 |
5.5 |
-1.3 |
0.800 |
0 |
0 |
0 |
0.007 |
46 |
50 |
|
[SO4]D:1011 |
3 |
1 |
186 |
f |
[SO4]D:1003 |
x,y,z |
1_555 |
1 |
1 |
185 |
2.9 |
-0.6 |
1.000 |
0 |
0 |
0 |
0.003 |
|