## |
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 |
320 |
68 |
22998 |
◊ |
A |
x,y,z |
1_555 |
311 |
66 |
22607 |
2996.6 |
-31.4 |
0.019 |
34 |
6 |
0 |
1.000 |
2 |
|
G |
304 |
63 |
22788 |
◊ |
G |
-x,y,-z+1/2 |
3_555 |
303 |
63 |
22788 |
2905.6 |
-30.9 |
0.019 |
34 |
6 |
0 |
1.000 |
Average: |
2951.1 |
-31.1 |
0.019 |
34 |
6 |
0 |
1.000 |
2 |
3 |
|
I |
114 |
26 |
7118 |
◊ |
H |
x,y,z |
1_555 |
116 |
25 |
5803 |
1139.9 |
-13.5 |
0.822 |
60 |
0 |
0 |
1.000 |
4 |
|
D |
116 |
27 |
7101 |
◊ |
C |
x,y,z |
1_555 |
120 |
25 |
5757 |
1130.6 |
-11.0 |
0.861 |
55 |
0 |
0 |
1.000 |
5 |
|
F |
111 |
26 |
7152 |
◊ |
E |
x,y,z |
1_555 |
112 |
25 |
5861 |
1114.4 |
-13.2 |
0.817 |
57 |
0 |
0 |
1.000 |
Average: |
1128.3 |
-12.6 |
0.833 |
57 |
0 |
0 |
1.000 |
3 |
6 |
|
D |
125 |
26 |
7101 |
◊ |
A |
x,y,z |
1_555 |
109 |
38 |
22607 |
1090.8 |
-19.2 |
0.351 |
15 |
0 |
0 |
1.000 |
7 |
|
I |
125 |
25 |
7118 |
◊ |
G |
x,y,z |
1_555 |
114 |
38 |
22788 |
1084.5 |
-18.5 |
0.396 |
14 |
0 |
0 |
1.000 |
8 |
|
F |
130 |
26 |
7152 |
◊ |
B |
x,y,z |
1_555 |
117 |
38 |
22998 |
1078.0 |
-18.7 |
0.396 |
14 |
0 |
0 |
1.000 |
Average: |
1084.4 |
-18.8 |
0.381 |
14 |
0 |
0 |
1.000 |
4 |
9 |
|
G |
100 |
25 |
22788 |
◊ |
A |
x,y,z |
1_555 |
98 |
24 |
22607 |
928.1 |
4.7 |
0.814 |
12 |
7 |
0 |
0.000 |
5 |
10 |
|
C |
101 |
15 |
5757 |
◊ |
A |
x,y,z |
1_555 |
101 |
28 |
22607 |
925.2 |
-11.9 |
0.607 |
17 |
0 |
0 |
1.000 |
11 |
|
H |
100 |
15 |
5803 |
◊ |
G |
x,y,z |
1_555 |
96 |
28 |
22788 |
915.4 |
-13.1 |
0.517 |
16 |
0 |
0 |
1.000 |
12 |
|
E |
96 |
15 |
5861 |
◊ |
B |
x,y,z |
1_555 |
101 |
29 |
22998 |
899.6 |
-11.0 |
0.589 |
17 |
0 |
0 |
1.000 |
Average: |
913.4 |
-12.0 |
0.571 |
17 |
0 |
0 |
1.000 |
6 |
13 |
|
D |
99 |
9 |
7101 |
◊ |
B |
x,y,z |
1_555 |
112 |
35 |
22998 |
908.1 |
-7.1 |
0.564 |
10 |
0 |
0 |
0.402 |
14 |
|
F |
98 |
9 |
7152 |
◊ |
A |
x,y,z |
1_555 |
115 |
37 |
22607 |
901.6 |
-10.1 |
0.495 |
10 |
0 |
0 |
0.402 |
15 |
|
I |
103 |
9 |
7118 |
◊ |
G |
-x,y,-z+1/2 |
3_555 |
104 |
34 |
22788 |
893.6 |
-9.2 |
0.511 |
10 |
0 |
0 |
0.402 |
Average: |
901.1 |
-8.8 |
0.523 |
10 |
0 |
0 |
0.402 |
7 |
16 |
|
B |
75 |
19 |
22998 |
◊ |
B |
x,-y,-z |
4_555 |
75 |
19 |
22998 |
739.9 |
1.5 |
0.683 |
2 |
4 |
0 |
0.000 |
8 |
17 |
|
G |
42 |
12 |
22788 |
◊ |
B |
x-1,y,z |
1_455 |
47 |
13 |
22998 |
387.7 |
0.3 |
0.604 |
5 |
3 |
0 |
0.000 |
9 |
18 |
|
C |
42 |
6 |
5757 |
◊ |
B |
x,y,z |
1_555 |
35 |
13 |
22998 |
305.3 |
2.1 |
0.869 |
5 |
0 |
0 |
0.000 |
19 |
|
E |
31 |
5 |
5861 |
◊ |
A |
x,y,z |
1_555 |
19 |
7 |
22607 |
171.4 |
1.5 |
0.844 |
2 |
0 |
0 |
0.000 |
20 |
|
H |
25 |
5 |
5803 |
◊ |
G |
-x,y,-z+1/2 |
3_555 |
17 |
7 |
22788 |
167.5 |
1.2 |
0.809 |
1 |
0 |
0 |
0.000 |
Average: |
214.7 |
1.6 |
0.841 |
3 |
0 |
0 |
0.000 |
10 |
21 |
|
A |
25 |
9 |
22607 |
◊ |
F |
x-1/2,-y-1/2,-z |
8_445 |
18 |
2 |
7152 |
146.5 |
0.4 |
0.566 |
0 |
0 |
0 |
0.000 |
11 |
22 |
|
G |
11 |
5 |
22788 |
◊ |
A |
x,-y,-z |
4_555 |
10 |
2 |
22607 |
88.3 |
-0.4 |
0.498 |
1 |
0 |
0 |
0.000 |
12 |
23 |
|
F |
8 |
2 |
7152 |
◊ |
B |
x-1/2,-y-1/2,-z |
8_445 |
12 |
4 |
22998 |
85.6 |
-4.3 |
0.181 |
0 |
0 |
0 |
0.000 |
13 |
24 |
|
I |
12 |
1 |
7118 |
◊ |
C |
x-1/2,y+1/2,z |
5_455 |
11 |
1 |
5757 |
78.0 |
1.8 |
0.807 |
0 |
0 |
0 |
0.000 |
25 |
|
H |
10 |
1 |
5803 |
◊ |
D |
x-1/2,y+1/2,z |
5_455 |
12 |
1 |
7101 |
76.5 |
1.4 |
0.780 |
0 |
0 |
0 |
0.000 |
Average: |
77.3 |
1.6 |
0.793 |
0 |
0 |
0 |
0.000 |
14 |
26 |
|
I |
12 |
1 |
7118 |
◊ |
D |
x-1/2,y+1/2,z |
5_455 |
12 |
1 |
7101 |
73.0 |
3.0 |
0.858 |
0 |
0 |
0 |
0.000 |
15 |
27 |
|
G |
9 |
3 |
22788 |
◊ |
E |
x-1/2,-y-1/2,-z |
8_445 |
11 |
2 |
5861 |
71.7 |
0.3 |
0.715 |
1 |
0 |
0 |
0.000 |
16 |
28 |
|
[SO4]D:101 |
4 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
11 |
3 |
7101 |
71.0 |
-9.9 |
0.835 |
0 |
0 |
0 |
0.276 |
17 |
29 |
|
[SO4]E:101 |
4 |
1 |
187 |
f |
E |
x,y,z |
1_555 |
10 |
3 |
5861 |
67.7 |
-8.4 |
0.896 |
1 |
0 |
0 |
0.323 |
18 |
30 |
|
A |
10 |
3 |
22607 |
◊ |
E |
x-1/2,-y-1/2,-z |
8_445 |
9 |
3 |
5861 |
65.2 |
-1.8 |
0.409 |
0 |
0 |
0 |
0.000 |
19 |
31 |
|
[SO4]D:101 |
4 |
1 |
186 |
◊ |
C |
x,y,z |
1_555 |
12 |
3 |
5757 |
62.3 |
-7.1 |
0.916 |
1 |
0 |
0 |
0.111 |
20 |
32 |
|
[SO4]C:101 |
4 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
11 |
3 |
5757 |
61.7 |
-7.9 |
0.878 |
1 |
0 |
0 |
0.299 |
21 |
33 |
|
[SO4]C:101 |
4 |
1 |
187 |
◊ |
D |
x,y,z |
1_555 |
9 |
3 |
7101 |
56.6 |
-6.8 |
0.831 |
0 |
0 |
0 |
0.101 |
22 |
34 |
|
A |
5 |
2 |
22607 |
◊ |
G |
-x,-y,z-1/2 |
2_554 |
6 |
1 |
22788 |
50.9 |
-0.9 |
0.276 |
0 |
0 |
0 |
0.000 |
23 |
35 |
|
[SO4]E:101 |
4 |
1 |
187 |
◊ |
F |
x,y,z |
1_555 |
8 |
3 |
7152 |
44.2 |
-5.6 |
0.777 |
0 |
0 |
0 |
0.106 |
24 |
36 |
|
A |
5 |
2 |
22607 |
◊ |
B |
x-1/2,-y-1/2,-z |
8_445 |
4 |
1 |
22998 |
20.0 |
0.2 |
0.625 |
0 |
0 |
0 |
0.000 |
25 |
37 |
|
E |
1 |
1 |
5861 |
◊ |
F |
x-1/2,-y-1/2,-z |
8_445 |
2 |
1 |
7152 |
13.5 |
-0.3 |
0.358 |
0 |
0 |
0 |
0.000 |
26 |
38 |
|
E |
2 |
2 |
5861 |
◊ |
A |
x-1/2,-y-1/2,-z |
8_445 |
2 |
1 |
22607 |
9.6 |
-0.6 |
0.353 |
0 |
0 |
0 |
0.000 |
27 |
39 |
|
G |
2 |
1 |
22788 |
◊ |
D |
x-1,y,z |
1_455 |
3 |
1 |
7101 |
6.3 |
-0.1 |
0.568 |
0 |
0 |
0 |
0.000 |
28 |
40 |
|
F |
1 |
1 |
7152 |
◊ |
A |
x-1/2,-y-1/2,-z |
8_445 |
1 |
1 |
22607 |
4.5 |
-0.2 |
0.368 |
0 |
0 |
0 |
0.000 |
|