## |
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 |
414 |
104 |
14671 |
◊ |
A |
x,y,z |
1_555 |
421 |
107 |
14423 |
4458.5 |
-93.8 |
0.002 |
18 |
9 |
0 |
0.830 |
2 |
|
D |
417 |
107 |
14597 |
◊ |
C |
x,y,z |
1_555 |
415 |
104 |
14490 |
4406.3 |
-94.6 |
0.004 |
20 |
8 |
0 |
0.830 |
3 |
|
E |
408 |
104 |
14203 |
◊ |
E |
-x,y,-z |
2_555 |
411 |
104 |
14203 |
4339.9 |
-93.7 |
0.008 |
20 |
8 |
0 |
0.830 |
Average: |
4401.6 |
-94.0 |
0.005 |
19 |
8 |
0 |
0.830 |
2 |
4 |
|
C |
64 |
17 |
14490 |
◊ |
B |
x,y,z |
1_555 |
62 |
17 |
14671 |
549.6 |
-2.7 |
0.863 |
6 |
3 |
0 |
0.038 |
5 |
|
D |
58 |
17 |
14597 |
◊ |
D |
-x,y,-z |
2_555 |
58 |
17 |
14597 |
549.1 |
-2.2 |
0.891 |
6 |
4 |
0 |
0.038 |
6 |
|
E |
62 |
18 |
14203 |
◊ |
A |
-x,y,-z |
2_555 |
61 |
17 |
14423 |
546.4 |
-2.1 |
0.895 |
6 |
4 |
0 |
0.038 |
Average: |
548.3 |
-2.3 |
0.883 |
6 |
4 |
0 |
0.038 |
3 |
7 |
|
A |
57 |
14 |
14423 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
58 |
14 |
14423 |
540.0 |
5.6 |
0.992 |
11 |
8 |
0 |
0.000 |
4 |
8 |
|
C |
45 |
14 |
14490 |
◊ |
A |
x,y,z |
1_555 |
38 |
9 |
14423 |
365.4 |
-1.6 |
0.837 |
2 |
7 |
0 |
0.056 |
9 |
|
E |
39 |
9 |
14203 |
◊ |
A |
x,y,z |
1_555 |
46 |
13 |
14423 |
363.8 |
-1.3 |
0.866 |
4 |
8 |
0 |
0.056 |
10 |
|
D |
48 |
14 |
14597 |
◊ |
C |
-x,y,-z |
2_555 |
40 |
10 |
14490 |
362.6 |
-2.4 |
0.830 |
2 |
6 |
0 |
0.056 |
11 |
|
E |
48 |
14 |
14203 |
◊ |
B |
-x,y,-z |
2_555 |
38 |
9 |
14671 |
361.2 |
-1.5 |
0.857 |
4 |
10 |
0 |
0.056 |
12 |
|
D |
38 |
9 |
14597 |
◊ |
B |
x,y,z |
1_555 |
47 |
14 |
14671 |
354.7 |
-1.5 |
0.848 |
3 |
7 |
0 |
0.056 |
Average: |
361.5 |
-1.6 |
0.847 |
3 |
8 |
0 |
0.056 |
5 |
13 |
|
D |
34 |
11 |
14597 |
◊ |
E |
-x+1/2,y-1/2,-z |
4_545 |
41 |
11 |
14203 |
336.7 |
-7.4 |
0.312 |
0 |
0 |
0 |
0.000 |
6 |
14 |
|
B |
32 |
9 |
14671 |
◊ |
B |
-x+1,y,-z |
2_655 |
32 |
9 |
14671 |
243.6 |
-1.0 |
0.811 |
4 |
0 |
0 |
0.000 |
7 |
15 |
|
C |
20 |
9 |
14490 |
◊ |
B |
-x+1/2,y-1/2,-z |
4_545 |
19 |
6 |
14671 |
165.9 |
-1.2 |
0.715 |
0 |
0 |
0 |
0.000 |
8 |
16 |
|
E |
9 |
4 |
14203 |
◊ |
E |
-x,y,-z+1 |
2_556 |
9 |
4 |
14203 |
104.3 |
-1.9 |
0.383 |
0 |
0 |
0 |
0.000 |
17 |
|
B |
10 |
4 |
14671 |
◊ |
A |
x,y,z-1 |
1_554 |
10 |
4 |
14423 |
102.2 |
-1.3 |
0.519 |
0 |
0 |
0 |
0.000 |
18 |
|
D |
9 |
3 |
14597 |
◊ |
C |
x,y,z-1 |
1_554 |
8 |
4 |
14490 |
99.7 |
-1.4 |
0.468 |
0 |
0 |
0 |
0.000 |
Average: |
102.1 |
-1.5 |
0.457 |
0 |
0 |
0 |
0.000 |
9 |
19 |
|
[SO4]A:401 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
14423 |
91.4 |
-13.4 |
0.886 |
5 |
0 |
0 |
0.114 |
10 |
20 |
|
[SO4]E:401 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
12 |
6 |
14203 |
90.9 |
-13.5 |
0.907 |
5 |
0 |
0 |
0.216 |
11 |
21 |
|
[SO4]D:401 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
10 |
5 |
14597 |
89.6 |
-14.0 |
0.846 |
5 |
0 |
0 |
0.129 |
12 |
22 |
|
[SO4]B:402 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
14671 |
74.3 |
-10.5 |
0.876 |
3 |
0 |
0 |
0.100 |
13 |
23 |
|
[SO4]A:401 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
7 |
5 |
14671 |
46.1 |
-6.2 |
0.762 |
0 |
0 |
0 |
0.045 |
14 |
24 |
|
[SO4]E:401 |
4 |
1 |
185 |
◊ |
E |
-x,y,-z |
2_555 |
6 |
4 |
14203 |
39.1 |
-5.2 |
0.795 |
0 |
0 |
0 |
0.071 |
15 |
25 |
|
[SO4]D:401 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
6 |
4 |
14490 |
38.9 |
-5.2 |
0.786 |
0 |
0 |
0 |
0.041 |
16 |
26 |
|
D |
3 |
3 |
14597 |
◊ |
A |
x,y,z |
1_555 |
3 |
3 |
14423 |
10.9 |
0.5 |
0.866 |
0 |
0 |
0 |
0.000 |
27 |
|
E |
3 |
3 |
14203 |
◊ |
B |
x,y,z |
1_555 |
3 |
3 |
14671 |
10.1 |
0.5 |
0.859 |
0 |
0 |
0 |
0.000 |
28 |
|
C |
2 |
2 |
14490 |
◊ |
C |
-x,y,-z |
2_555 |
2 |
2 |
14490 |
9.9 |
0.5 |
0.882 |
0 |
0 |
0 |
0.000 |
Average: |
10.3 |
0.5 |
0.869 |
0 |
0 |
0 |
0.000 |
17 |
29 |
|
[SO4]B:402 |
1 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
14423 |
5.3 |
-0.4 |
0.850 |
0 |
0 |
0 |
0.003 |
|