| ## |
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 |
100 |
22 |
5001 |
◊ |
C |
x,y,z |
1_555 |
96 |
22 |
4987 |
963.0 |
-13.2 |
0.710 |
46 |
0 |
0 |
0.849 |
| 2 |
2 |
|
C |
77 |
14 |
4987 |
◊ |
B |
x,y,z |
1_555 |
88 |
27 |
11446 |
710.4 |
-4.5 |
0.670 |
14 |
0 |
0 |
0.264 |
3 |
|
D |
74 |
15 |
5001 |
◊ |
A |
x,y,z |
1_555 |
82 |
26 |
11038 |
688.0 |
-3.5 |
0.678 |
13 |
0 |
0 |
0.264 |
| Average: |
699.2 |
-4.0 |
0.674 |
14 |
0 |
0 |
0.264 |
| 3 |
4 |
|
C |
78 |
15 |
4987 |
◊ |
A |
x,y,z |
1_555 |
70 |
21 |
11038 |
701.5 |
-1.1 |
0.791 |
14 |
0 |
0 |
0.201 |
5 |
|
D |
77 |
15 |
5001 |
◊ |
B |
x,y,z |
1_555 |
70 |
21 |
11446 |
689.2 |
-0.9 |
0.817 |
16 |
0 |
0 |
0.201 |
| Average: |
695.3 |
-1.0 |
0.804 |
15 |
0 |
0 |
0.201 |
| 4 |
6 |
|
E |
72 |
20 |
9324 |
◊ |
B |
x,y,z |
1_555 |
67 |
21 |
11446 |
686.4 |
2.5 |
0.622 |
10 |
5 |
0 |
0.000 |
| 5 |
7 |
|
E |
71 |
19 |
9324 |
◊ |
A |
x,y,z |
1_555 |
70 |
20 |
11038 |
663.1 |
1.3 |
0.617 |
11 |
2 |
0 |
0.000 |
| 6 |
8 |
|
B |
73 |
20 |
11446 |
◊ |
A |
x,y,z-1 |
1_554 |
72 |
20 |
11038 |
616.8 |
-0.6 |
0.424 |
7 |
5 |
0 |
0.000 |
| 7 |
9 |
|
E |
65 |
24 |
9324 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
65 |
17 |
11038 |
585.2 |
-2.2 |
0.416 |
4 |
2 |
0 |
0.000 |
| 8 |
10 |
|
E |
47 |
16 |
9324 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
36 |
8 |
11446 |
354.6 |
-3.1 |
0.318 |
2 |
2 |
0 |
0.047 |
| 9 |
11 |
|
B |
30 |
10 |
11446 |
◊ |
A |
x,y,z |
1_555 |
32 |
10 |
11038 |
289.3 |
-0.5 |
0.477 |
1 |
0 |
0 |
0.013 |
| 10 |
12 |
|
B |
23 |
9 |
11446 |
◊ |
E |
x,y,z-1 |
1_554 |
17 |
7 |
9324 |
231.3 |
-2.9 |
0.171 |
1 |
0 |
0 |
0.000 |
| 11 |
13 |
|
E |
26 |
10 |
9324 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
24 |
4 |
4987 |
204.0 |
-5.6 |
0.365 |
4 |
0 |
0 |
0.143 |
| 12 |
14 |
|
E |
21 |
6 |
9324 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
21 |
4 |
5001 |
175.6 |
-3.4 |
0.472 |
2 |
0 |
0 |
0.083 |
| 13 |
15 |
|
D |
11 |
1 |
5001 |
x |
D |
x-1,y,z |
1_455 |
11 |
1 |
5001 |
81.4 |
2.7 |
0.834 |
0 |
0 |
0 |
0.000 |
16 |
|
C |
13 |
1 |
4987 |
x |
C |
x-1,y,z |
1_455 |
11 |
1 |
4987 |
81.3 |
2.4 |
0.825 |
0 |
0 |
0 |
0.000 |
| Average: |
81.4 |
2.6 |
0.829 |
0 |
0 |
0 |
0.000 |
| 14 |
17 |
|
D |
10 |
1 |
5001 |
◊ |
C |
x-1,y,z |
1_455 |
9 |
1 |
4987 |
68.7 |
0.8 |
0.715 |
0 |
0 |
0 |
0.000 |
| 15 |
18 |
|
B |
6 |
1 |
11446 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
3 |
2 |
11038 |
56.0 |
1.0 |
0.813 |
2 |
0 |
0 |
0.000 |
| 16 |
19 |
|
C |
1 |
1 |
4987 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
9324 |
15.6 |
-0.9 |
0.304 |
0 |
0 |
0 |
0.000 |
| 17 |
20 |
|
B |
2 |
1 |
11446 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
1 |
1 |
4987 |
12.1 |
-0.6 |
0.354 |
0 |
0 |
0 |
0.000 |
| 18 |
21 |
|
[ZN]A:501 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
2 |
1 |
4987 |
8.8 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.151 |
22 |
|
[ZN]B:501 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
2 |
1 |
5001 |
7.7 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.151 |
| Average: |
8.3 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.151 |
| 19 |
23 |
|
D |
1 |
1 |
5001 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
9324 |
2.2 |
0.0 |
0.485 |
0 |
0 |
0 |
0.000 |
|