| ## |
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 |
56 |
19 |
27096 |
◊ |
A |
x-1,y,z |
1_455 |
55 |
17 |
27130 |
560.0 |
-4.9 |
0.205 |
4 |
1 |
0 |
0.000 |
2 |
|
B |
56 |
18 |
27096 |
◊ |
A |
x,y,z |
1_555 |
57 |
19 |
27130 |
541.0 |
-6.6 |
0.104 |
3 |
0 |
0 |
0.000 |
| Average: |
550.5 |
-5.7 |
0.154 |
4 |
1 |
0 |
0.000 |
| 2 |
3 |
|
A |
41 |
14 |
27130 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
40 |
16 |
27096 |
403.7 |
-1.3 |
0.483 |
8 |
0 |
0 |
0.000 |
4 |
|
A |
38 |
15 |
27130 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
39 |
13 |
27096 |
394.9 |
-1.3 |
0.480 |
9 |
1 |
0 |
0.000 |
| Average: |
399.3 |
-1.3 |
0.482 |
9 |
1 |
0 |
0.000 |
| 3 |
5 |
|
A |
39 |
14 |
27130 |
x |
A |
x,y,z-1 |
1_554 |
37 |
15 |
27130 |
334.1 |
0.3 |
0.645 |
2 |
2 |
0 |
0.000 |
6 |
|
B |
38 |
14 |
27096 |
x |
B |
x,y,z-1 |
1_554 |
36 |
11 |
27096 |
324.8 |
0.1 |
0.629 |
3 |
2 |
0 |
0.000 |
| Average: |
329.5 |
0.2 |
0.637 |
3 |
2 |
0 |
0.000 |
| 4 |
7 |
|
A |
36 |
13 |
27130 |
x |
A |
x-1,y,z |
1_455 |
34 |
13 |
27130 |
320.0 |
1.6 |
0.667 |
4 |
0 |
0 |
0.000 |
8 |
|
B |
35 |
13 |
27096 |
x |
B |
x-1,y,z |
1_455 |
37 |
13 |
27096 |
315.9 |
1.7 |
0.727 |
4 |
0 |
0 |
0.000 |
| Average: |
317.9 |
1.6 |
0.697 |
4 |
0 |
0 |
0.000 |
| 5 |
9 |
|
[TRS]B:805 |
7 |
1 |
252 |
f |
B |
x,y,z |
1_555 |
25 |
12 |
27096 |
177.1 |
4.2 |
0.457 |
4 |
0 |
0 |
0.000 |
| 6 |
10 |
|
[SO4]A:804 |
5 |
1 |
190 |
f |
A |
x,y,z |
1_555 |
17 |
10 |
27130 |
134.4 |
-18.8 |
0.589 |
2 |
0 |
0 |
0.023 |
| 7 |
11 |
|
[SO4]B:803 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
27096 |
104.9 |
-14.1 |
0.798 |
2 |
0 |
0 |
0.024 |
| 8 |
12 |
|
[SO4]A:803 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
27130 |
102.3 |
-13.1 |
0.822 |
3 |
0 |
0 |
0.017 |
| 9 |
13 |
|
[SO4]A:805 |
5 |
1 |
189 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
27130 |
81.3 |
-11.4 |
0.834 |
4 |
0 |
0 |
0.015 |
| 10 |
14 |
|
[SO4]B:804 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
27096 |
80.0 |
-11.3 |
0.830 |
3 |
0 |
0 |
0.020 |
| 11 |
15 |
|
[SO4]A:801 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
27130 |
76.7 |
-12.0 |
0.573 |
2 |
0 |
0 |
0.015 |
| 12 |
16 |
|
[SO4]B:801 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
27096 |
76.0 |
-11.8 |
0.576 |
2 |
0 |
0 |
0.020 |
| 13 |
17 |
|
[SO4]A:802 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
8 |
2 |
27130 |
71.0 |
-9.5 |
0.830 |
3 |
0 |
0 |
0.013 |
| 14 |
18 |
|
[SO4]B:802 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
9 |
2 |
27096 |
68.9 |
-9.0 |
0.839 |
3 |
0 |
0 |
0.016 |
| 15 |
19 |
|
[CU]A:806 |
1 |
1 |
125 |
cf |
A |
x,y,z |
1_555 |
8 |
6 |
27130 |
65.5 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.019 |
20 |
|
[CU]B:806 |
1 |
1 |
125 |
cf |
B |
x,y,z |
1_555 |
9 |
6 |
27096 |
65.4 |
-11.7 |
0.000 |
0 |
0 |
0 |
0.019 |
| Average: |
65.5 |
-11.7 |
0.000 |
0 |
0 |
0 |
0.019 |
| 16 |
21 |
|
A |
6 |
2 |
27130 |
◊ |
B |
x,y,z-1 |
1_554 |
10 |
3 |
27096 |
57.5 |
-0.4 |
0.492 |
0 |
0 |
0 |
0.000 |
22 |
|
B |
7 |
2 |
27096 |
◊ |
A |
x-1,y,z+1 |
1_456 |
8 |
2 |
27130 |
45.9 |
-0.9 |
0.309 |
0 |
0 |
0 |
0.000 |
| Average: |
51.7 |
-0.7 |
0.401 |
0 |
0 |
0 |
0.000 |
| 17 |
23 |
|
[SO4]B:804 |
1 |
1 |
187 |
f |
[SO4]B:802 |
x,y,z |
1_555 |
1 |
1 |
187 |
12.5 |
-3.0 |
0.800 |
0 |
0 |
0 |
0.005 |
| 18 |
24 |
|
[SO4]A:805 |
1 |
1 |
189 |
f |
[SO4]A:802 |
x,y,z |
1_555 |
1 |
1 |
187 |
11.4 |
-2.7 |
0.800 |
0 |
0 |
0 |
0.003 |
| 19 |
25 |
|
A |
2 |
1 |
27130 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
2 |
27096 |
7.4 |
0.3 |
0.794 |
0 |
0 |
0 |
0.000 |
26 |
|
A |
2 |
2 |
27130 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
2 |
1 |
27096 |
2.4 |
0.1 |
0.680 |
0 |
0 |
0 |
0.000 |
| Average: |
4.9 |
0.2 |
0.737 |
0 |
0 |
0 |
0.000 |
|