| ## |
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 |
|
F |
332 |
83 |
12621 |
◊ |
D |
x,y,z |
1_555 |
332 |
79 |
12321 |
3159.3 |
-39.6 |
0.049 |
38 |
0 |
0 |
0.723 |
2 |
|
E |
336 |
80 |
12549 |
◊ |
C |
x,y,z |
1_555 |
341 |
81 |
12516 |
3152.3 |
-38.0 |
0.056 |
28 |
0 |
0 |
0.723 |
3 |
|
B |
331 |
82 |
12630 |
◊ |
B |
-x,y,-z+1 |
2_556 |
330 |
82 |
12630 |
3116.1 |
-43.0 |
0.042 |
34 |
0 |
0 |
0.723 |
4 |
|
A |
335 |
80 |
12602 |
◊ |
A |
-x,y,-z+1 |
2_556 |
334 |
80 |
12602 |
3098.2 |
-41.0 |
0.059 |
32 |
0 |
0 |
0.723 |
| Average: |
3131.5 |
-40.4 |
0.051 |
33 |
0 |
0 |
0.723 |
| 2 |
5 |
|
D |
100 |
29 |
12321 |
◊ |
C |
x,y,z |
1_555 |
92 |
28 |
12516 |
876.1 |
-4.5 |
0.569 |
12 |
8 |
0 |
0.237 |
6 |
|
B |
96 |
30 |
12630 |
◊ |
A |
x,y,z |
1_555 |
102 |
28 |
12602 |
856.4 |
-5.8 |
0.554 |
12 |
8 |
0 |
0.237 |
7 |
|
F |
88 |
26 |
12621 |
◊ |
E |
x,y,z |
1_555 |
89 |
26 |
12549 |
808.6 |
-4.1 |
0.580 |
12 |
9 |
0 |
0.237 |
| Average: |
847.1 |
-4.8 |
0.568 |
12 |
8 |
0 |
0.237 |
| 3 |
8 |
|
A |
49 |
14 |
12602 |
◊ |
D |
-x+1/2,y-1/2,-z+1 |
4_546 |
44 |
11 |
12321 |
444.8 |
-4.3 |
0.402 |
5 |
0 |
0 |
0.000 |
| 4 |
9 |
|
F |
41 |
10 |
12621 |
◊ |
C |
-x+1/2,y-1/2,-z |
4_545 |
39 |
8 |
12516 |
411.5 |
-3.1 |
0.456 |
6 |
1 |
0 |
0.000 |
| 5 |
10 |
|
E |
39 |
9 |
12549 |
◊ |
B |
x,y,z |
1_555 |
44 |
11 |
12630 |
396.9 |
-3.1 |
0.483 |
6 |
3 |
0 |
0.000 |
| 6 |
11 |
|
A |
30 |
7 |
12602 |
◊ |
F |
x-1/2,y-1/2,z |
3_445 |
36 |
8 |
12621 |
280.8 |
-1.2 |
0.598 |
7 |
1 |
0 |
0.000 |
| 7 |
12 |
|
A |
26 |
8 |
12602 |
◊ |
D |
-x+1/2,y-1/2,-z |
4_545 |
23 |
8 |
12321 |
216.0 |
-1.8 |
0.446 |
3 |
0 |
0 |
0.000 |
| 8 |
13 |
|
B |
20 |
6 |
12630 |
◊ |
A |
-x,y,-z+1 |
2_556 |
19 |
6 |
12602 |
190.8 |
-5.3 |
0.041 |
0 |
0 |
0 |
0.047 |
14 |
|
F |
20 |
6 |
12621 |
◊ |
C |
x,y,z |
1_555 |
20 |
7 |
12516 |
187.4 |
-5.2 |
0.038 |
0 |
0 |
0 |
0.047 |
15 |
|
E |
21 |
6 |
12549 |
◊ |
D |
x,y,z |
1_555 |
19 |
5 |
12321 |
186.1 |
-5.1 |
0.041 |
0 |
0 |
0 |
0.047 |
| Average: |
188.1 |
-5.2 |
0.040 |
0 |
0 |
0 |
0.047 |
| 9 |
16 |
|
B |
13 |
4 |
12630 |
◊ |
B |
-x,y,-z |
2_555 |
14 |
4 |
12630 |
132.1 |
0.3 |
0.740 |
4 |
0 |
0 |
0.000 |
| 10 |
17 |
|
C |
13 |
4 |
12516 |
◊ |
E |
x,y,z-1 |
1_554 |
17 |
5 |
12549 |
114.7 |
-0.4 |
0.560 |
1 |
0 |
0 |
0.000 |
| 11 |
18 |
|
[SO4]B:1001 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
12630 |
84.0 |
-10.1 |
0.954 |
4 |
0 |
0 |
0.291 |
| 12 |
19 |
|
[SO4]D:1004 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
13 |
4 |
12516 |
82.1 |
-9.7 |
0.956 |
2 |
0 |
0 |
0.210 |
| 13 |
20 |
|
[SO4]D:1003 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
10 |
4 |
12321 |
80.3 |
-9.5 |
0.973 |
5 |
0 |
0 |
0.231 |
| 14 |
21 |
|
[SO4]E:1005 |
5 |
1 |
186 |
f |
E |
x,y,z |
1_555 |
8 |
3 |
12549 |
80.2 |
-10.9 |
0.811 |
2 |
0 |
0 |
0.216 |
| 15 |
22 |
|
[SO4]B:1002 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
12602 |
77.2 |
-9.3 |
0.971 |
3 |
0 |
0 |
0.277 |
| 16 |
23 |
|
[SO4]E:1006 |
5 |
1 |
186 |
◊ |
E |
x,y,z |
1_555 |
8 |
4 |
12549 |
77.1 |
-9.3 |
0.951 |
4 |
0 |
0 |
0.202 |
| 17 |
24 |
|
[SO4]E:1006 |
5 |
1 |
186 |
f |
F |
x,y,z |
1_555 |
11 |
4 |
12621 |
73.5 |
-11.3 |
0.438 |
0 |
0 |
0 |
0.207 |
| 18 |
25 |
|
[SO4]E:1005 |
5 |
1 |
186 |
◊ |
F |
x,y,z |
1_555 |
7 |
4 |
12621 |
71.7 |
-8.0 |
0.981 |
4 |
0 |
0 |
0.178 |
| 19 |
26 |
|
[SO4]D:1003 |
5 |
1 |
186 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
12516 |
67.3 |
-8.2 |
0.890 |
1 |
0 |
0 |
0.170 |
| 20 |
27 |
|
[SO4]D:1004 |
5 |
1 |
186 |
◊ |
D |
x,y,z |
1_555 |
10 |
3 |
12321 |
66.7 |
-8.2 |
0.869 |
1 |
0 |
0 |
0.172 |
| 21 |
28 |
|
[SO4]B:1002 |
5 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
12630 |
63.8 |
-8.1 |
0.884 |
2 |
0 |
0 |
0.172 |
| 22 |
29 |
|
[SO4]B:1001 |
5 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
12602 |
60.2 |
-7.4 |
0.889 |
2 |
0 |
0 |
0.160 |
| 23 |
30 |
|
C |
8 |
1 |
12516 |
◊ |
B |
-x,y,-z+1 |
2_556 |
9 |
2 |
12630 |
52.6 |
-1.1 |
0.414 |
0 |
0 |
0 |
0.000 |
| 24 |
31 |
|
A |
7 |
3 |
12602 |
◊ |
F |
-x+1/2,y-1/2,-z+1 |
4_546 |
4 |
2 |
12621 |
51.2 |
0.3 |
0.570 |
0 |
0 |
0 |
0.000 |
32 |
|
A |
1 |
1 |
12602 |
◊ |
D |
x-1/2,y-1/2,z |
3_445 |
1 |
1 |
12321 |
1.3 |
-0.0 |
0.518 |
0 |
0 |
0 |
0.000 |
| Average: |
26.3 |
0.1 |
0.544 |
0 |
0 |
0 |
0.000 |
| 25 |
33 |
|
D |
3 |
1 |
12321 |
x |
D |
x,y,z-1 |
1_554 |
8 |
3 |
12321 |
42.1 |
1.0 |
0.787 |
1 |
0 |
0 |
0.000 |
| 26 |
34 |
|
D |
6 |
2 |
12321 |
◊ |
E |
-x+1/2,y-1/2,-z |
4_545 |
4 |
2 |
12549 |
41.5 |
0.0 |
0.666 |
1 |
0 |
0 |
0.000 |
| 27 |
35 |
|
A |
4 |
1 |
12602 |
x |
A |
x,y,z-1 |
1_554 |
5 |
3 |
12602 |
35.4 |
0.0 |
0.633 |
0 |
0 |
0 |
0.000 |
| 28 |
36 |
|
F |
5 |
1 |
12621 |
◊ |
E |
x,y,z-1 |
1_554 |
4 |
1 |
12549 |
34.6 |
-0.5 |
0.450 |
0 |
0 |
0 |
0.000 |
| 29 |
37 |
|
F |
7 |
3 |
12621 |
x |
F |
x,y,z-1 |
1_554 |
4 |
1 |
12621 |
33.1 |
-0.1 |
0.603 |
0 |
0 |
0 |
0.000 |
|