| ## |
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 |
141 |
37 |
16346 |
◊ |
A |
x,y,z |
1_555 |
150 |
38 |
16333 |
1335.8 |
-9.7 |
0.376 |
15 |
9 |
0 |
0.525 |
2 |
|
C |
148 |
38 |
15888 |
◊ |
B |
x,y,z |
1_555 |
148 |
39 |
15921 |
1334.4 |
-8.8 |
0.442 |
16 |
7 |
0 |
0.525 |
| Average: |
1335.1 |
-9.2 |
0.409 |
16 |
8 |
0 |
0.525 |
| 2 |
3 |
|
D |
116 |
31 |
16346 |
◊ |
C |
x,y,z |
1_555 |
124 |
31 |
15888 |
1156.9 |
-9.2 |
0.335 |
12 |
2 |
0 |
0.382 |
4 |
|
B |
123 |
32 |
15921 |
◊ |
A |
x,y,z |
1_555 |
126 |
33 |
16333 |
1133.8 |
-6.2 |
0.501 |
14 |
1 |
0 |
0.382 |
| Average: |
1145.3 |
-7.7 |
0.418 |
13 |
2 |
0 |
0.382 |
| 3 |
5 |
|
D |
59 |
17 |
16346 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
62 |
18 |
16333 |
513.2 |
-5.5 |
0.294 |
0 |
0 |
0 |
0.000 |
6 |
|
B |
47 |
16 |
15921 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
56 |
18 |
15888 |
448.4 |
-5.2 |
0.293 |
4 |
1 |
0 |
0.000 |
| Average: |
480.8 |
-5.3 |
0.293 |
2 |
1 |
0 |
0.000 |
| 4 |
7 |
|
D |
54 |
15 |
16346 |
◊ |
A |
x,y-1,z |
1_545 |
55 |
15 |
16333 |
482.4 |
-0.2 |
0.688 |
8 |
2 |
0 |
0.000 |
8 |
|
B |
48 |
14 |
15921 |
◊ |
C |
x,y-1,z |
1_545 |
52 |
14 |
15888 |
456.4 |
-0.0 |
0.716 |
10 |
1 |
0 |
0.000 |
| Average: |
469.4 |
-0.1 |
0.702 |
9 |
2 |
0 |
0.000 |
| 5 |
9 |
|
C |
29 |
8 |
15888 |
x |
C |
x,y-1,z |
1_545 |
27 |
7 |
15888 |
270.2 |
-2.0 |
0.459 |
1 |
0 |
0 |
0.000 |
10 |
|
D |
28 |
7 |
16346 |
x |
D |
x,y-1,z |
1_545 |
27 |
8 |
16346 |
260.9 |
-2.7 |
0.366 |
1 |
0 |
0 |
0.000 |
| Average: |
265.5 |
-2.3 |
0.412 |
1 |
0 |
0 |
0.000 |
| 6 |
11 |
|
A |
21 |
8 |
16333 |
x |
A |
x,y-1,z |
1_545 |
19 |
6 |
16333 |
197.8 |
-1.1 |
0.488 |
2 |
0 |
0 |
0.000 |
12 |
|
B |
7 |
4 |
15921 |
x |
B |
x,y-1,z |
1_545 |
13 |
6 |
15921 |
92.5 |
-1.2 |
0.281 |
0 |
0 |
0 |
0.000 |
| Average: |
145.2 |
-1.2 |
0.385 |
1 |
0 |
0 |
0.000 |
| 7 |
13 |
|
C |
17 |
7 |
15888 |
◊ |
B |
x,y,z-1 |
1_554 |
20 |
7 |
15921 |
150.8 |
-1.0 |
0.508 |
1 |
0 |
0 |
0.000 |
| 8 |
14 |
|
B |
16 |
5 |
15921 |
x |
B |
-x+1,y-1/2,-z+1 |
2_646 |
17 |
4 |
15921 |
125.7 |
-0.5 |
0.510 |
2 |
0 |
0 |
0.000 |
| 9 |
15 |
|
D |
15 |
4 |
16346 |
◊ |
A |
x,y,z-1 |
1_554 |
12 |
3 |
16333 |
109.5 |
-0.3 |
0.593 |
1 |
0 |
0 |
0.000 |
| 10 |
16 |
|
C |
11 |
5 |
15888 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
16333 |
98.1 |
-0.4 |
0.573 |
0 |
0 |
0 |
0.016 |
17 |
|
D |
9 |
5 |
16346 |
◊ |
B |
x,y,z |
1_555 |
9 |
5 |
15921 |
92.6 |
-0.4 |
0.513 |
1 |
2 |
0 |
0.016 |
| Average: |
95.3 |
-0.4 |
0.543 |
1 |
1 |
0 |
0.016 |
| 11 |
18 |
|
[SO4]C:4001 |
5 |
1 |
182 |
f |
C |
x,y,z |
1_555 |
9 |
4 |
15888 |
83.5 |
-10.0 |
0.940 |
5 |
0 |
0 |
0.367 |
| 12 |
19 |
|
[SO4]D:4002 |
5 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
8 |
4 |
16346 |
74.7 |
-9.1 |
0.931 |
6 |
0 |
0 |
0.348 |
| 13 |
20 |
|
D |
3 |
2 |
16346 |
x |
D |
-x,y-1/2,-z-1 |
2_544 |
8 |
4 |
16346 |
53.5 |
1.2 |
0.748 |
1 |
0 |
0 |
0.000 |
| 14 |
21 |
|
B |
9 |
3 |
15921 |
◊ |
A |
x,y-1,z |
1_545 |
11 |
4 |
16333 |
47.3 |
0.3 |
0.690 |
0 |
0 |
0 |
0.000 |
| 15 |
22 |
|
[SO4]D:4002 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
16333 |
38.2 |
-3.8 |
0.952 |
1 |
0 |
0 |
0.127 |
| 16 |
23 |
|
[SO4]C:4001 |
3 |
1 |
182 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
15921 |
34.4 |
-3.8 |
0.913 |
1 |
0 |
0 |
0.126 |
| 17 |
24 |
|
D |
3 |
1 |
16346 |
x |
D |
-x,y-1/2,-z |
2_545 |
1 |
1 |
16346 |
10.1 |
-0.1 |
0.377 |
0 |
0 |
0 |
0.000 |
| 18 |
25 |
|
B |
1 |
1 |
15921 |
◊ |
C |
x,y-1,z+1 |
1_546 |
1 |
1 |
15888 |
0.7 |
0.0 |
0.637 |
0 |
0 |
0 |
0.000 |
|