| ## |
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 |
|
[NAD]A:1248 |
43 |
1 |
795 |
f |
A |
x,y,z |
1_555 |
73 |
24 |
10391 |
560.2 |
-5.6 |
0.551 |
9 |
0 |
0 |
0.291 |
2 |
|
[NAD]B:1250 |
42 |
1 |
797 |
f |
B |
x,y,z |
1_555 |
69 |
24 |
10420 |
546.4 |
-4.3 |
0.610 |
14 |
0 |
0 |
0.291 |
| Average: |
553.3 |
-5.0 |
0.580 |
12 |
0 |
0 |
0.291 |
| 2 |
3 |
|
D |
47 |
14 |
10322 |
◊ |
A |
x,y,z |
1_555 |
48 |
15 |
10391 |
450.7 |
1.7 |
0.730 |
7 |
2 |
0 |
0.000 |
| 3 |
4 |
|
C |
45 |
13 |
10349 |
◊ |
A |
x,y,z |
1_555 |
54 |
15 |
10391 |
432.9 |
-0.9 |
0.519 |
6 |
1 |
0 |
0.057 |
| 4 |
5 |
|
D |
42 |
13 |
10322 |
◊ |
B |
x,y,z |
1_555 |
38 |
10 |
10420 |
371.1 |
-5.4 |
0.141 |
2 |
0 |
0 |
0.000 |
| 5 |
6 |
|
D |
41 |
10 |
10322 |
◊ |
C |
-x+1/2,y-1/2,-z+1 |
4_546 |
41 |
13 |
10349 |
362.9 |
-4.0 |
0.234 |
3 |
0 |
0 |
0.000 |
| 6 |
7 |
|
B |
45 |
14 |
10420 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
37 |
11 |
10391 |
338.6 |
-3.5 |
0.280 |
4 |
0 |
0 |
0.000 |
| 7 |
8 |
|
B |
34 |
11 |
10420 |
◊ |
B |
-x,y,-z |
2_555 |
33 |
11 |
10420 |
312.5 |
-1.7 |
0.432 |
0 |
0 |
0 |
0.023 |
| 8 |
9 |
|
D |
27 |
8 |
10322 |
◊ |
D |
-x+1,y,-z+1 |
2_656 |
26 |
8 |
10322 |
245.3 |
2.3 |
0.799 |
8 |
0 |
0 |
0.000 |
10 |
|
C |
25 |
9 |
10349 |
◊ |
B |
x,y,z |
1_555 |
23 |
8 |
10420 |
230.5 |
1.4 |
0.727 |
7 |
0 |
0 |
0.000 |
| Average: |
237.9 |
1.9 |
0.763 |
8 |
0 |
0 |
0.000 |
| 9 |
11 |
|
D |
22 |
11 |
10322 |
◊ |
C |
x,y,z |
1_555 |
22 |
9 |
10349 |
195.3 |
-0.2 |
0.548 |
1 |
1 |
0 |
0.000 |
12 |
|
C |
23 |
9 |
10349 |
◊ |
D |
x-1/2,y+1/2,z |
3_455 |
25 |
8 |
10322 |
184.0 |
0.4 |
0.550 |
0 |
0 |
0 |
0.000 |
| Average: |
189.6 |
0.1 |
0.549 |
1 |
1 |
0 |
0.000 |
| 10 |
13 |
|
B |
19 |
6 |
10420 |
◊ |
A |
x-1/2,y-1/2,z |
3_445 |
19 |
5 |
10391 |
174.1 |
0.9 |
0.694 |
3 |
1 |
0 |
0.000 |
| 11 |
14 |
|
C |
14 |
6 |
10349 |
◊ |
A |
x-1/2,y-1/2,z |
3_445 |
15 |
5 |
10391 |
158.6 |
-0.1 |
0.575 |
2 |
0 |
0 |
0.000 |
| 12 |
15 |
|
B |
15 |
5 |
10420 |
◊ |
A |
x,y,z |
1_555 |
15 |
5 |
10391 |
114.2 |
-0.5 |
0.503 |
1 |
0 |
0 |
0.000 |
| 13 |
16 |
|
[SO4]C:1252 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
16 |
8 |
10349 |
108.2 |
-13.0 |
0.884 |
6 |
0 |
0 |
0.242 |
| 14 |
17 |
|
D |
9 |
3 |
10322 |
◊ |
C |
x,y-1,z |
1_545 |
14 |
6 |
10349 |
100.4 |
0.8 |
0.644 |
0 |
0 |
0 |
0.000 |
| 15 |
18 |
|
[SO4]A:1249 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
10391 |
99.9 |
-13.5 |
0.827 |
2 |
0 |
0 |
0.222 |
| 16 |
19 |
|
[SO4]D:1249 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
17 |
6 |
10322 |
95.2 |
-12.1 |
0.846 |
1 |
0 |
0 |
0.054 |
| 17 |
20 |
|
[SO4]B:1251 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
10420 |
80.2 |
-10.7 |
0.811 |
6 |
0 |
0 |
0.368 |
| 18 |
21 |
|
D |
8 |
6 |
10322 |
◊ |
B |
-x+1/2,y-1/2,-z |
4_545 |
14 |
7 |
10420 |
79.8 |
1.0 |
0.700 |
1 |
0 |
0 |
0.000 |
| 19 |
22 |
|
[SO4]D:1248 |
5 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
8 |
4 |
10322 |
77.4 |
-8.5 |
0.957 |
5 |
0 |
0 |
0.046 |
| 20 |
23 |
|
[SO4]B:1251 |
5 |
1 |
186 |
◊ |
B |
-x,y,-z |
2_555 |
13 |
5 |
10420 |
71.1 |
-10.2 |
0.608 |
3 |
0 |
0 |
0.318 |
| 21 |
24 |
|
[SO4]A:1250 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
10391 |
63.2 |
-7.2 |
0.915 |
3 |
0 |
0 |
0.132 |
| 22 |
25 |
|
A |
9 |
4 |
10391 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
9 |
4 |
10391 |
55.7 |
0.2 |
0.631 |
0 |
0 |
0 |
0.000 |
| 23 |
26 |
|
[SO4]A:1250 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
9 |
6 |
10349 |
54.5 |
-6.9 |
0.838 |
2 |
0 |
0 |
0.120 |
| 24 |
27 |
|
[SO4]A:1249 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
4 |
1 |
10349 |
41.0 |
-3.6 |
0.955 |
1 |
0 |
0 |
0.063 |
| 25 |
28 |
|
D |
1 |
1 |
10322 |
◊ |
A |
x,y-1,z |
1_545 |
4 |
2 |
10391 |
25.9 |
-0.6 |
0.169 |
0 |
0 |
0 |
0.000 |
| 26 |
29 |
|
C |
2 |
2 |
10349 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
4 |
3 |
10391 |
21.6 |
-0.6 |
0.268 |
0 |
0 |
0 |
0.000 |
| 27 |
30 |
|
D |
4 |
2 |
10322 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
1 |
1 |
10391 |
17.9 |
0.8 |
0.807 |
0 |
0 |
0 |
0.000 |
| 28 |
31 |
|
D |
1 |
1 |
10322 |
◊ |
A |
x-1/2,y-1/2,z |
3_445 |
1 |
1 |
10391 |
14.4 |
0.3 |
0.379 |
0 |
0 |
0 |
0.000 |
| 29 |
32 |
|
[SO4]A:1250 |
1 |
1 |
185 |
f |
[NAD]A:1248 |
x,y,z |
1_555 |
2 |
1 |
795 |
6.1 |
-1.0 |
0.556 |
0 |
0 |
0 |
0.016 |
| 30 |
33 |
|
[NAD]A:1248 |
1 |
1 |
795 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
10349 |
0.6 |
0.0 |
0.558 |
0 |
0 |
0 |
0.000 |
| 31 |
34 |
|
B |
1 |
1 |
10420 |
◊ |
C |
-x+1/2,y-1/2,-z |
4_545 |
1 |
1 |
10349 |
0.1 |
0.0 |
0.658 |
0 |
0 |
0 |
0.000 |
|