## |
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 |
284 |
71 |
18813 |
◊ |
A |
x,y,z |
1_555 |
288 |
77 |
18981 |
2729.7 |
-18.1 |
0.167 |
43 |
6 |
0 |
0.315 |
2 |
2 |
|
D |
62 |
16 |
1757 |
◊ |
B |
x,y,z |
1_555 |
99 |
30 |
18813 |
694.7 |
-8.3 |
0.629 |
11 |
0 |
0 |
0.288 |
3 |
3 |
|
A |
73 |
19 |
18981 |
◊ |
A |
-x,y,-z-1/2 |
3_554 |
73 |
19 |
18981 |
678.8 |
1.5 |
0.778 |
6 |
0 |
0 |
0.000 |
4 |
4 |
|
C |
49 |
14 |
1521 |
◊ |
A |
x,y,z |
1_555 |
92 |
36 |
18981 |
581.6 |
-4.7 |
0.756 |
6 |
0 |
0 |
0.120 |
5 |
5 |
|
A |
52 |
19 |
18981 |
◊ |
B |
x-1/2,-y-1/2,-z |
8_445 |
54 |
18 |
18813 |
482.3 |
-8.4 |
0.053 |
0 |
0 |
0 |
0.000 |
6 |
6 |
|
B |
51 |
17 |
18813 |
◊ |
B |
x,-y,-z |
4_555 |
51 |
17 |
18813 |
432.1 |
1.9 |
0.784 |
8 |
0 |
0 |
0.022 |
7 |
7 |
|
D |
22 |
8 |
1757 |
◊ |
A |
x,y,z |
1_555 |
26 |
11 |
18981 |
211.4 |
-1.6 |
0.695 |
7 |
0 |
0 |
0.033 |
8 |
8 |
|
C |
16 |
5 |
1521 |
◊ |
B |
x,y,z |
1_555 |
21 |
7 |
18813 |
156.8 |
-1.5 |
0.702 |
2 |
0 |
0 |
0.017 |
9 |
9 |
|
A |
15 |
4 |
18981 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
16 |
4 |
18981 |
132.0 |
-0.0 |
0.617 |
0 |
2 |
0 |
0.000 |
10 |
10 |
|
A |
17 |
7 |
18981 |
◊ |
A |
x,-y,-z |
4_555 |
17 |
7 |
18981 |
116.3 |
0.8 |
0.738 |
0 |
0 |
0 |
0.000 |
11 |
11 |
|
B |
12 |
3 |
18813 |
◊ |
A |
x,-y,-z |
4_555 |
10 |
3 |
18981 |
97.9 |
0.6 |
0.715 |
0 |
0 |
0 |
0.000 |
12 |
12 |
|
[SO4]A:502 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
18981 |
86.7 |
-12.3 |
0.771 |
5 |
0 |
0 |
0.235 |
13 |
13 |
|
[SO4]B:504 |
5 |
1 |
186 |
f |
B |
x,-y,-z |
4_555 |
15 |
6 |
18813 |
78.7 |
-8.8 |
0.966 |
3 |
0 |
0 |
0.274 |
14 |
14 |
|
[SO4]B:506 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
18813 |
77.4 |
-10.1 |
0.832 |
3 |
0 |
0 |
0.308 |
15 |
15 |
|
[SO4]A:505 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
18981 |
68.9 |
-8.5 |
0.921 |
4 |
0 |
0 |
0.167 |
16 |
16 |
|
[SO4]A:503 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
18981 |
64.0 |
-8.3 |
0.861 |
2 |
0 |
0 |
0.149 |
17 |
17 |
|
[SO4]A:501 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
18981 |
63.0 |
-9.0 |
0.505 |
1 |
0 |
0 |
0.153 |
18 |
18 |
|
[SO4]B:504 |
5 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
9 |
6 |
18813 |
59.1 |
-7.1 |
0.895 |
1 |
0 |
0 |
0.204 |
19 |
19 |
|
B |
4 |
2 |
18813 |
◊ |
A |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
3 |
2 |
18981 |
44.6 |
-0.4 |
0.346 |
0 |
0 |
0 |
0.000 |
20 |
20 |
|
[CO]A:500 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
18981 |
43.1 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.192 |
21 |
|
[CO]B:500 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
18813 |
41.8 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.192 |
Average: |
42.5 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.192 |
21 |
22 |
|
[CO]A:500 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
9 |
4 |
1521 |
37.8 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.059 |
22 |
23 |
|
[CO]B:500 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
7 |
2 |
1757 |
35.0 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.089 |
23 |
24 |
|
[SO4]A:503 |
3 |
1 |
186 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
3 |
1 |
18981 |
28.4 |
-3.2 |
0.880 |
1 |
0 |
0 |
0.000 |
24 |
25 |
|
[CO]B:500 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
18981 |
17.8 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.029 |
26 |
|
[CO]A:500 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
18813 |
17.5 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.029 |
Average: |
17.6 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.029 |
25 |
27 |
|
[SO4]A:502 |
1 |
1 |
187 |
◊ |
B |
x,-y,-z |
4_555 |
1 |
1 |
18813 |
7.7 |
-1.0 |
0.446 |
0 |
0 |
0 |
0.008 |
26 |
28 |
|
[SO4]A:505 |
1 |
1 |
186 |
◊ |
A |
x,-y,-z |
4_555 |
1 |
1 |
18981 |
5.3 |
-0.5 |
0.839 |
0 |
0 |
0 |
0.003 |
27 |
29 |
|
[SO4]A:502 |
1 |
1 |
187 |
◊ |
[SO4]A:502 |
x,-y,-z |
4_555 |
1 |
1 |
187 |
2.3 |
-0.6 |
1.000 |
0 |
0 |
0 |
0.002 |
|