## |
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 |
70 |
19 |
13516 |
◊ |
B |
x,y,z |
1_555 |
67 |
16 |
13579 |
613.6 |
-1.1 |
0.394 |
8 |
3 |
0 |
0.000 |
2 |
2 |
|
B |
66 |
19 |
13579 |
x |
B |
-x+1,y-1/2,-z+2 |
2_647 |
69 |
20 |
13579 |
599.2 |
-3.3 |
0.451 |
4 |
1 |
0 |
0.000 |
3 |
|
A |
70 |
19 |
13518 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
65 |
18 |
13518 |
591.2 |
-2.2 |
0.503 |
2 |
1 |
0 |
0.000 |
4 |
|
D |
65 |
18 |
13516 |
x |
D |
-x+2,y-1/2,-z+2 |
2_747 |
67 |
21 |
13516 |
579.2 |
-1.7 |
0.536 |
3 |
2 |
0 |
0.000 |
5 |
|
C |
66 |
18 |
13609 |
x |
C |
-x+2,y-1/2,-z+1 |
2_746 |
63 |
19 |
13609 |
553.1 |
-2.3 |
0.518 |
8 |
2 |
0 |
0.000 |
Average: |
580.7 |
-2.4 |
0.502 |
4 |
2 |
0 |
0.000 |
3 |
6 |
|
C |
54 |
16 |
13609 |
◊ |
A |
x,y,z |
1_555 |
51 |
14 |
13518 |
469.1 |
-0.3 |
0.502 |
8 |
1 |
0 |
0.000 |
4 |
7 |
|
[DCF]A:353 |
19 |
1 |
427 |
f |
A |
x,y,z |
1_555 |
45 |
22 |
13518 |
272.2 |
0.1 |
0.115 |
7 |
0 |
0 |
0.007 |
8 |
|
[DCF]D:1853 |
19 |
1 |
426 |
f |
D |
x,y,z |
1_555 |
41 |
21 |
13516 |
271.1 |
0.9 |
0.141 |
7 |
0 |
0 |
0.007 |
9 |
|
[DCF]B:853 |
19 |
1 |
425 |
f |
B |
x,y,z |
1_555 |
46 |
22 |
13579 |
268.5 |
0.8 |
0.180 |
8 |
0 |
0 |
0.007 |
10 |
|
[DCF]C:1353 |
19 |
1 |
426 |
f |
C |
x,y,z |
1_555 |
45 |
21 |
13609 |
267.7 |
0.3 |
0.149 |
7 |
0 |
0 |
0.007 |
Average: |
269.9 |
0.5 |
0.146 |
7 |
0 |
0 |
0.007 |
5 |
11 |
|
A |
24 |
9 |
13518 |
◊ |
C |
x-1,y,z |
1_455 |
24 |
8 |
13609 |
235.3 |
0.1 |
0.640 |
3 |
3 |
0 |
0.000 |
6 |
12 |
|
C |
22 |
10 |
13609 |
◊ |
D |
-x+2,y-1/2,-z+2 |
2_747 |
23 |
9 |
13516 |
156.8 |
2.1 |
0.855 |
0 |
2 |
0 |
0.000 |
7 |
13 |
|
D |
16 |
6 |
13516 |
◊ |
B |
-x+2,y-1/2,-z+2 |
2_747 |
17 |
5 |
13579 |
138.6 |
-0.2 |
0.594 |
0 |
0 |
0 |
0.000 |
14 |
|
C |
13 |
3 |
13609 |
◊ |
A |
-x+2,y-1/2,-z+1 |
2_746 |
13 |
3 |
13518 |
108.5 |
0.1 |
0.594 |
0 |
0 |
0 |
0.000 |
Average: |
123.6 |
-0.1 |
0.594 |
0 |
0 |
0 |
0.000 |
8 |
15 |
|
B |
18 |
8 |
13579 |
◊ |
D |
x-1,y,z |
1_455 |
16 |
5 |
13516 |
137.1 |
-0.8 |
0.493 |
2 |
3 |
0 |
0.000 |
9 |
16 |
|
A |
19 |
8 |
13518 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
20 |
8 |
13579 |
130.5 |
0.8 |
0.732 |
1 |
1 |
0 |
0.000 |
10 |
17 |
|
[ZN]A:400 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
13518 |
35.8 |
-27.1 |
0.000 |
0 |
0 |
0 |
0.064 |
18 |
|
[ZN]B:900 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
13579 |
35.8 |
-26.2 |
0.000 |
0 |
0 |
0 |
0.064 |
19 |
|
[ZN]D:1900 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
9 |
5 |
13516 |
35.7 |
-26.1 |
0.000 |
0 |
0 |
0 |
0.064 |
20 |
|
[ZN]C:1400 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
13609 |
34.8 |
-25.6 |
0.000 |
0 |
0 |
0 |
0.064 |
Average: |
35.5 |
-26.3 |
0.000 |
0 |
0 |
0 |
0.064 |
11 |
21 |
|
[DCF]C:1353 |
7 |
1 |
426 |
cf |
[ZN]C:1400 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.8 |
-13.0 |
0.000 |
0 |
0 |
0 |
0.031 |
22 |
|
[DCF]B:853 |
6 |
1 |
425 |
cf |
[ZN]B:900 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.4 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.031 |
23 |
|
[DCF]A:353 |
7 |
1 |
427 |
cf |
[ZN]A:400 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.3 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.031 |
24 |
|
[DCF]D:1853 |
6 |
1 |
426 |
cf |
[ZN]D:1900 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.2 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.031 |
Average: |
30.4 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.031 |
12 |
25 |
|
C |
3 |
1 |
13609 |
◊ |
B |
-x+2,y-1/2,-z+2 |
2_747 |
1 |
1 |
13579 |
14.7 |
0.6 |
0.816 |
0 |
0 |
0 |
0.000 |
13 |
26 |
|
A |
3 |
2 |
13518 |
◊ |
D |
-x+2,y-1/2,-z+2 |
2_747 |
3 |
2 |
13516 |
11.7 |
0.4 |
0.760 |
0 |
0 |
0 |
0.000 |
|