## |
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 |
|
D |
152 |
44 |
16469 |
◊ |
C |
x,y,z |
1_555 |
139 |
50 |
15819 |
1326.6 |
-3.7 |
0.531 |
14 |
7 |
0 |
0.278 |
2 |
|
B |
142 |
42 |
16354 |
◊ |
A |
x,y,z |
1_555 |
143 |
42 |
16243 |
1307.9 |
-5.7 |
0.453 |
15 |
10 |
0 |
0.278 |
Average: |
1317.2 |
-4.7 |
0.492 |
15 |
9 |
0 |
0.278 |
2 |
3 |
|
D |
99 |
32 |
16469 |
◊ |
B |
x,y,z |
1_555 |
106 |
30 |
16354 |
950.6 |
-9.4 |
0.130 |
10 |
0 |
0 |
0.000 |
4 |
|
A |
99 |
32 |
16243 |
◊ |
C |
x,y,z-1 |
1_554 |
90 |
27 |
15819 |
855.3 |
-7.2 |
0.118 |
14 |
1 |
0 |
0.000 |
Average: |
902.9 |
-8.3 |
0.124 |
12 |
1 |
0 |
0.000 |
3 |
5 |
|
C |
61 |
18 |
15819 |
◊ |
D |
x-1,y,z |
1_455 |
63 |
21 |
16469 |
574.4 |
-2.4 |
0.468 |
7 |
2 |
0 |
0.000 |
4 |
6 |
|
C |
54 |
22 |
15819 |
◊ |
D |
x,y-1,z |
1_545 |
54 |
20 |
16469 |
512.4 |
-0.6 |
0.584 |
7 |
5 |
0 |
0.000 |
5 |
7 |
|
A |
51 |
17 |
16243 |
◊ |
D |
x-1,y,z |
1_455 |
53 |
18 |
16469 |
490.0 |
-6.1 |
0.167 |
6 |
0 |
0 |
0.000 |
6 |
8 |
|
A |
48 |
19 |
16243 |
◊ |
B |
x,y-1,z |
1_545 |
58 |
22 |
16354 |
466.1 |
0.7 |
0.718 |
4 |
4 |
0 |
0.000 |
7 |
9 |
|
A |
53 |
14 |
16243 |
◊ |
C |
x-1,y,z |
1_455 |
47 |
14 |
15819 |
448.4 |
-2.8 |
0.162 |
2 |
0 |
0 |
0.000 |
8 |
10 |
|
A |
44 |
15 |
16243 |
◊ |
B |
x-1,y,z |
1_455 |
45 |
15 |
16354 |
406.4 |
-4.5 |
0.234 |
2 |
0 |
0 |
0.000 |
9 |
11 |
|
D |
44 |
13 |
16469 |
x |
D |
x-1,y,z |
1_455 |
43 |
14 |
16469 |
364.1 |
-2.1 |
0.402 |
2 |
1 |
0 |
0.000 |
10 |
12 |
|
C |
38 |
12 |
15819 |
◊ |
B |
x-1,y,z+1 |
1_456 |
35 |
12 |
16354 |
320.7 |
-4.9 |
0.118 |
0 |
0 |
0 |
0.000 |
11 |
13 |
|
B |
28 |
13 |
16354 |
◊ |
D |
x,y,z-1 |
1_554 |
31 |
11 |
16469 |
287.3 |
-0.3 |
0.547 |
3 |
0 |
0 |
0.000 |
14 |
|
C |
33 |
13 |
15819 |
◊ |
A |
x,y,z |
1_555 |
33 |
11 |
16243 |
283.5 |
-1.4 |
0.457 |
2 |
0 |
0 |
0.000 |
Average: |
285.4 |
-0.9 |
0.502 |
3 |
0 |
0 |
0.000 |
12 |
15 |
|
B |
27 |
13 |
16354 |
x |
B |
x-1,y,z |
1_455 |
30 |
13 |
16354 |
226.0 |
-0.7 |
0.471 |
2 |
0 |
0 |
0.000 |
13 |
16 |
|
C |
19 |
7 |
15819 |
x |
C |
x-1,y,z |
1_455 |
20 |
8 |
15819 |
188.2 |
0.8 |
0.624 |
2 |
2 |
0 |
0.000 |
14 |
17 |
|
[NAG]B:386 |
12 |
1 |
365 |
cf |
B |
x,y,z |
1_555 |
20 |
9 |
16354 |
170.7 |
5.3 |
0.548 |
1 |
0 |
0 |
0.000 |
18 |
|
[NAG]C:386 |
13 |
1 |
363 |
cf |
C |
x,y,z |
1_555 |
19 |
8 |
15819 |
167.1 |
5.7 |
0.538 |
2 |
0 |
0 |
0.000 |
19 |
|
[NAG]A:386 |
12 |
1 |
357 |
cf |
A |
x,y,z |
1_555 |
21 |
9 |
16243 |
156.2 |
4.4 |
0.450 |
2 |
0 |
0 |
0.000 |
Average: |
164.7 |
5.1 |
0.512 |
2 |
0 |
0 |
0.000 |
15 |
20 |
|
[NAG]D:386 |
13 |
1 |
353 |
cf |
D |
x,y,z |
1_555 |
18 |
9 |
16469 |
163.1 |
4.6 |
0.482 |
2 |
0 |
0 |
0.000 |
16 |
21 |
|
B |
21 |
10 |
16354 |
◊ |
D |
x-1,y,z |
1_455 |
13 |
5 |
16469 |
148.1 |
0.9 |
0.745 |
2 |
0 |
0 |
0.000 |
17 |
22 |
|
[SO4]A:401 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
24 |
12 |
16243 |
134.7 |
-20.1 |
0.641 |
6 |
0 |
0 |
0.363 |
18 |
23 |
|
[SO4]B:1402 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
16354 |
116.6 |
-16.6 |
0.717 |
0 |
0 |
0 |
0.265 |
19 |
24 |
|
[NAG]A:387 |
9 |
1 |
363 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
16243 |
110.8 |
1.7 |
0.291 |
3 |
0 |
0 |
0.000 |
20 |
25 |
|
A |
11 |
3 |
16243 |
x |
A |
x-1,y,z |
1_455 |
17 |
8 |
16243 |
106.7 |
1.4 |
0.798 |
2 |
0 |
0 |
0.000 |
21 |
26 |
|
C |
10 |
5 |
15819 |
◊ |
A |
x-1,y,z+1 |
1_456 |
13 |
5 |
16243 |
80.6 |
0.6 |
0.603 |
1 |
0 |
0 |
0.000 |
22 |
27 |
|
[SO4]D:3401 |
4 |
1 |
187 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
16469 |
80.2 |
-12.3 |
0.624 |
4 |
0 |
0 |
0.356 |
23 |
28 |
|
[NAG]C:387 |
6 |
1 |
344 |
f |
C |
x,y,z |
1_555 |
10 |
6 |
15819 |
76.6 |
-0.0 |
0.156 |
0 |
0 |
0 |
0.002 |
24 |
29 |
|
[SO4]B:1401 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
16354 |
74.5 |
-6.1 |
0.990 |
5 |
0 |
0 |
0.133 |
25 |
30 |
|
[NAG]B:387 |
9 |
1 |
362 |
cf |
[NAG]B:386 |
x,y,z |
1_555 |
7 |
1 |
365 |
73.7 |
1.6 |
0.090 |
1 |
0 |
0 |
0.000 |
26 |
31 |
|
[NAG]C:387 |
6 |
1 |
344 |
cf |
[NAG]C:386 |
x,y,z |
1_555 |
7 |
1 |
363 |
73.2 |
2.2 |
0.151 |
0 |
0 |
0 |
0.000 |
27 |
32 |
|
[SO4]A:402 |
4 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
16243 |
72.2 |
-8.1 |
0.957 |
3 |
0 |
0 |
0.150 |
28 |
33 |
|
[SO4]D:3402 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
7 |
4 |
16469 |
72.0 |
-9.2 |
0.947 |
3 |
0 |
0 |
0.266 |
29 |
34 |
|
[SO4]C:2401 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
15819 |
71.5 |
-8.4 |
0.910 |
2 |
0 |
0 |
0.396 |
30 |
35 |
|
[NAG]A:387 |
10 |
1 |
363 |
cf |
[NAG]A:386 |
x,y,z |
1_555 |
6 |
1 |
357 |
70.7 |
1.5 |
0.077 |
0 |
0 |
0 |
0.000 |
31 |
36 |
|
D |
6 |
3 |
16469 |
◊ |
C |
x-1,y+1,z |
1_465 |
6 |
4 |
15819 |
48.4 |
0.2 |
0.645 |
0 |
0 |
0 |
0.000 |
32 |
37 |
|
[NAG]B:387 |
6 |
1 |
362 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
16354 |
44.0 |
0.5 |
0.212 |
0 |
0 |
0 |
0.000 |
33 |
38 |
|
[SO4]D:3402 |
4 |
1 |
186 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
15819 |
42.2 |
-3.8 |
0.960 |
1 |
0 |
0 |
0.108 |
34 |
39 |
|
D |
6 |
3 |
16469 |
◊ |
[SO4]D:3401 |
x-1,y,z |
1_455 |
4 |
1 |
187 |
40.2 |
-4.7 |
0.722 |
1 |
0 |
0 |
0.000 |
35 |
40 |
|
[NAG]B:386 |
7 |
1 |
365 |
◊ |
D |
x,y,z |
1_555 |
4 |
3 |
16469 |
31.8 |
0.4 |
0.204 |
0 |
0 |
0 |
0.000 |
41 |
|
A |
2 |
1 |
16243 |
◊ |
[NAG]C:386 |
x,y,z-1 |
1_554 |
2 |
1 |
363 |
20.7 |
0.1 |
0.268 |
0 |
0 |
0 |
0.000 |
Average: |
26.2 |
0.2 |
0.236 |
0 |
0 |
0 |
0.000 |
36 |
42 |
|
[SO4]A:402 |
2 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
16354 |
20.2 |
-2.2 |
0.901 |
0 |
0 |
0 |
0.035 |
37 |
43 |
|
A |
2 |
2 |
16243 |
◊ |
[NAG]B:387 |
x,y-1,z |
1_545 |
2 |
1 |
362 |
20.2 |
0.9 |
0.676 |
0 |
0 |
0 |
0.000 |
38 |
44 |
|
[SO4]B:1401 |
1 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
16243 |
11.0 |
-1.2 |
0.797 |
0 |
0 |
0 |
0.019 |
39 |
45 |
|
[SO4]C:2401 |
2 |
1 |
187 |
◊ |
D |
x,y,z |
1_555 |
2 |
2 |
16469 |
10.0 |
-1.1 |
0.861 |
0 |
0 |
0 |
0.027 |
40 |
46 |
|
C |
1 |
1 |
15819 |
◊ |
[SO4]D:3401 |
x,y-1,z |
1_545 |
1 |
1 |
187 |
5.0 |
-0.7 |
0.476 |
0 |
0 |
0 |
0.000 |
41 |
47 |
|
D |
1 |
1 |
16469 |
◊ |
B |
x-1,y,z+1 |
1_456 |
1 |
1 |
16354 |
4.6 |
0.1 |
0.773 |
0 |
0 |
0 |
0.000 |
42 |
48 |
|
A |
3 |
1 |
16243 |
◊ |
[SO4]B:1402 |
x-1,y,z |
1_455 |
1 |
1 |
185 |
3.8 |
-0.5 |
0.758 |
0 |
0 |
0 |
0.000 |
43 |
49 |
|
A |
1 |
1 |
16243 |
◊ |
D |
x,y-1,z |
1_545 |
1 |
1 |
16469 |
0.9 |
0.0 |
0.686 |
0 |
0 |
0 |
0.000 |
|