## |
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 |
|
A |
72 |
20 |
10938 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
56 |
12 |
10765 |
625.9 |
-12.5 |
0.028 |
2 |
0 |
0 |
0.539 |
2 |
|
B |
69 |
21 |
11051 |
◊ |
A |
x,y,z |
1_555 |
55 |
13 |
10938 |
611.5 |
-12.5 |
0.020 |
5 |
2 |
0 |
0.539 |
Average: |
618.7 |
-12.5 |
0.024 |
4 |
1 |
0 |
0.539 |
2 |
3 |
|
E |
59 |
13 |
11025 |
◊ |
D |
x,y,z |
1_555 |
76 |
26 |
10765 |
623.1 |
-12.2 |
0.040 |
0 |
0 |
0 |
0.610 |
4 |
|
C |
68 |
21 |
10417 |
◊ |
B |
x,y,z |
1_555 |
47 |
10 |
11051 |
533.2 |
-13.1 |
0.011 |
0 |
0 |
0 |
0.610 |
Average: |
578.1 |
-12.6 |
0.026 |
0 |
0 |
0 |
0.610 |
3 |
5 |
|
H |
38 |
8 |
7073 |
◊ |
E |
x,y,z |
1_555 |
54 |
16 |
11025 |
455.8 |
-11.5 |
0.061 |
1 |
1 |
0 |
0.301 |
4 |
6 |
|
E |
43 |
13 |
11025 |
◊ |
C |
x,y,z |
1_555 |
60 |
20 |
10417 |
450.7 |
-5.5 |
0.240 |
1 |
0 |
0 |
0.011 |
7 |
|
D |
58 |
18 |
10765 |
◊ |
B |
x,y,z |
1_555 |
40 |
13 |
11051 |
446.0 |
-4.0 |
0.251 |
1 |
0 |
0 |
0.011 |
Average: |
448.4 |
-4.7 |
0.245 |
1 |
0 |
0 |
0.011 |
5 |
8 |
|
B |
44 |
12 |
11051 |
◊ |
E |
x,y-1,z |
1_545 |
44 |
14 |
11025 |
441.2 |
2.3 |
0.835 |
2 |
0 |
0 |
0.000 |
6 |
9 |
|
B |
37 |
12 |
11051 |
◊ |
C |
x-1,y,z |
1_455 |
30 |
10 |
10417 |
308.4 |
-1.3 |
0.434 |
0 |
2 |
0 |
0.000 |
7 |
10 |
|
A |
34 |
9 |
10938 |
◊ |
B |
x-1,y,z |
1_455 |
36 |
10 |
11051 |
300.0 |
2.4 |
0.782 |
1 |
0 |
0 |
0.000 |
8 |
11 |
|
A |
34 |
7 |
10938 |
x |
A |
-x,y-1/2,-z+1 |
2_546 |
32 |
12 |
10938 |
294.4 |
-2.1 |
0.373 |
1 |
1 |
0 |
0.000 |
9 |
12 |
|
C |
27 |
8 |
10417 |
◊ |
H |
-x+1,y-1/2,-z |
2_645 |
33 |
12 |
7073 |
284.5 |
-6.3 |
0.122 |
1 |
0 |
0 |
0.000 |
10 |
13 |
|
A |
16 |
5 |
10938 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
24 |
10 |
10765 |
197.4 |
-1.8 |
0.261 |
0 |
0 |
0 |
0.000 |
11 |
14 |
|
C |
22 |
9 |
10417 |
◊ |
E |
x,y-1,z |
1_545 |
15 |
5 |
11025 |
117.1 |
-0.4 |
0.602 |
0 |
1 |
0 |
0.000 |
15 |
|
B |
11 |
5 |
11051 |
◊ |
D |
x,y-1,z |
1_545 |
17 |
7 |
10765 |
99.6 |
0.7 |
0.746 |
0 |
0 |
0 |
0.000 |
Average: |
108.4 |
0.2 |
0.674 |
0 |
1 |
0 |
0.000 |
12 |
16 |
|
A |
17 |
6 |
10938 |
x |
A |
x-1,y,z |
1_455 |
13 |
3 |
10938 |
105.0 |
0.3 |
0.661 |
0 |
0 |
0 |
0.000 |
13 |
17 |
|
[PO4]B:402 |
5 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
11051 |
101.8 |
-7.0 |
0.677 |
3 |
0 |
0 |
0.391 |
14 |
18 |
|
[PO4]A:402 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
10938 |
100.0 |
-7.0 |
0.645 |
3 |
0 |
0 |
0.159 |
15 |
19 |
|
[PO4]D:402 |
5 |
1 |
187 |
f |
D |
x,y,z |
1_555 |
14 |
7 |
10765 |
97.6 |
-6.6 |
0.714 |
2 |
0 |
0 |
0.377 |
16 |
20 |
|
E |
14 |
5 |
11025 |
◊ |
B |
x,y,z |
1_555 |
15 |
4 |
11051 |
96.8 |
-1.2 |
0.446 |
0 |
0 |
0 |
0.001 |
17 |
21 |
|
A |
10 |
4 |
10938 |
◊ |
D |
x-1,y-1,z |
1_445 |
12 |
5 |
10765 |
80.5 |
1.5 |
0.832 |
0 |
0 |
0 |
0.000 |
18 |
22 |
|
D |
15 |
6 |
10765 |
x |
D |
x-1,y,z |
1_455 |
10 |
2 |
10765 |
77.1 |
0.8 |
0.730 |
0 |
0 |
0 |
0.000 |
19 |
23 |
|
[ZN]H:401 |
1 |
1 |
98 |
f |
H |
x,y,z |
1_555 |
7 |
5 |
7073 |
46.9 |
-28.2 |
0.000 |
0 |
0 |
0 |
0.699 |
20 |
24 |
|
[PO4]D:402 |
4 |
1 |
187 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
11025 |
19.7 |
-0.3 |
0.961 |
0 |
0 |
0 |
0.013 |
21 |
25 |
|
H |
1 |
1 |
7073 |
x |
H |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
7073 |
14.8 |
0.3 |
0.842 |
0 |
0 |
0 |
0.000 |
22 |
26 |
|
D |
1 |
1 |
10765 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
10938 |
0.8 |
-0.0 |
0.590 |
0 |
0 |
0 |
0.000 |
|