| ## |
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 |
103 |
26 |
12543 |
◊ |
A |
x,y,z |
1_555 |
104 |
26 |
12461 |
1060.5 |
-6.9 |
0.273 |
9 |
0 |
0 |
0.027 |
| 2 |
2 |
|
B |
53 |
15 |
12543 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
50 |
15 |
12461 |
465.3 |
0.9 |
0.713 |
2 |
0 |
0 |
0.000 |
| 3 |
3 |
|
B |
19 |
6 |
12543 |
x |
B |
-x-1,y-1/2,-z-1/2 |
3_444 |
19 |
6 |
12543 |
201.3 |
-3.8 |
0.099 |
0 |
0 |
0 |
0.000 |
| 4 |
4 |
|
A |
20 |
8 |
12461 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
24 |
11 |
12461 |
165.5 |
0.0 |
0.622 |
0 |
0 |
0 |
0.000 |
| 5 |
5 |
|
[KOJ]A:1351 |
10 |
1 |
276 |
f |
A |
x,y,z |
1_555 |
30 |
11 |
12461 |
156.5 |
3.4 |
0.291 |
0 |
0 |
0 |
0.000 |
| 6 |
6 |
|
[KOJ]B:1351 |
10 |
1 |
279 |
f |
B |
x,y,z |
1_555 |
30 |
11 |
12543 |
151.0 |
3.5 |
0.294 |
1 |
0 |
0 |
0.000 |
| 7 |
7 |
|
A |
16 |
6 |
12461 |
x |
A |
x-1,y,z |
1_455 |
16 |
6 |
12461 |
147.7 |
-0.3 |
0.477 |
0 |
0 |
0 |
0.000 |
| 8 |
8 |
|
B |
14 |
5 |
12543 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
17 |
7 |
12461 |
144.6 |
2.8 |
0.889 |
2 |
0 |
0 |
0.000 |
| 9 |
9 |
|
A |
9 |
3 |
12461 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
10 |
4 |
12543 |
76.1 |
-1.6 |
0.252 |
0 |
0 |
0 |
0.000 |
| 10 |
10 |
|
[CU]A:501 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
14 |
9 |
12461 |
61.2 |
-13.5 |
0.000 |
0 |
0 |
0 |
0.072 |
11 |
|
[CU]B:501 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
14 |
9 |
12543 |
59.2 |
-15.2 |
0.000 |
0 |
0 |
0 |
0.072 |
| Average: |
60.2 |
-14.3 |
0.000 |
0 |
0 |
0 |
0.072 |
| 11 |
12 |
|
[ZN]B:505 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
12543 |
56.6 |
-33.8 |
0.000 |
0 |
0 |
0 |
0.167 |
13 |
|
[ZN]A:506 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
12461 |
56.1 |
-32.5 |
0.000 |
0 |
0 |
0 |
0.167 |
| Average: |
56.4 |
-33.1 |
0.000 |
0 |
0 |
0 |
0.167 |
| 12 |
14 |
|
[CU]A:502 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
7 |
12461 |
55.4 |
-12.9 |
0.000 |
0 |
0 |
0 |
0.066 |
15 |
|
[CU]B:502 |
1 |
1 |
125 |
cf |
B |
x,y,z |
1_555 |
10 |
7 |
12543 |
55.2 |
-13.4 |
0.000 |
0 |
0 |
0 |
0.066 |
| Average: |
55.3 |
-13.2 |
0.000 |
0 |
0 |
0 |
0.066 |
| 13 |
16 |
|
[ZN]B:507 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
12543 |
53.0 |
-31.1 |
0.000 |
0 |
0 |
0 |
0.155 |
17 |
|
[ZN]A:510 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
12461 |
51.5 |
-30.3 |
0.000 |
0 |
0 |
0 |
0.155 |
| Average: |
52.3 |
-30.7 |
0.000 |
0 |
0 |
0 |
0.155 |
| 14 |
18 |
|
[ZN]A:507 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
13 |
4 |
12461 |
53.0 |
-25.6 |
0.000 |
0 |
0 |
0 |
0.110 |
19 |
|
B |
12 |
4 |
12543 |
◊ |
[ZN]A:504 |
-x-1/2,-y,z-1/2 |
2_454 |
1 |
1 |
98 |
51.5 |
-23.8 |
0.000 |
0 |
0 |
0 |
0.110 |
| Average: |
52.3 |
-24.7 |
0.000 |
0 |
0 |
0 |
0.110 |
| 15 |
20 |
|
B |
3 |
3 |
12543 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
6 |
2 |
12461 |
50.9 |
0.6 |
0.789 |
1 |
0 |
0 |
0.000 |
| 16 |
21 |
|
[ZN]A:505 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
12461 |
50.6 |
-28.5 |
0.000 |
0 |
0 |
0 |
0.072 |
| 17 |
22 |
|
[ZN]B:506 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
12543 |
49.0 |
-30.1 |
0.000 |
0 |
0 |
0 |
0.139 |
23 |
|
[ZN]A:509 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
12461 |
45.2 |
-24.8 |
0.000 |
0 |
0 |
0 |
0.139 |
| Average: |
47.1 |
-27.4 |
0.000 |
0 |
0 |
0 |
0.139 |
| 18 |
24 |
|
[ZN]A:503 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
12461 |
47.8 |
-26.8 |
0.000 |
0 |
0 |
0 |
0.126 |
25 |
|
[ZN]B:503 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
12543 |
45.0 |
-23.2 |
0.000 |
0 |
0 |
0 |
0.126 |
| Average: |
46.4 |
-25.0 |
0.000 |
0 |
0 |
0 |
0.126 |
| 19 |
26 |
|
[ZN]B:504 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
12543 |
39.0 |
-18.4 |
0.000 |
0 |
0 |
0 |
0.047 |
| 20 |
27 |
|
B |
7 |
3 |
12543 |
◊ |
[ZN]A:508 |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
98 |
36.0 |
-16.6 |
0.000 |
0 |
0 |
0 |
0.042 |
| 21 |
28 |
|
[ZN]A:508 |
1 |
1 |
98 |
cf |
A |
x,y,z |
1_555 |
3 |
1 |
12461 |
35.8 |
-16.4 |
0.000 |
0 |
0 |
0 |
0.042 |
| 22 |
29 |
|
[ZN]A:504 |
1 |
1 |
98 |
cf |
A |
x,y,z |
1_555 |
3 |
1 |
12461 |
33.8 |
-14.6 |
0.000 |
0 |
0 |
0 |
0.069 |
30 |
|
B |
3 |
1 |
12543 |
cf |
[ZN]A:507 |
-x-1/2,-y,z-1/2 |
2_454 |
1 |
1 |
98 |
32.6 |
-12.8 |
0.000 |
0 |
0 |
0 |
0.069 |
| Average: |
33.2 |
-13.7 |
0.000 |
0 |
0 |
0 |
0.069 |
| 23 |
31 |
|
B |
5 |
2 |
12543 |
◊ |
A |
x-1,y,z |
1_455 |
3 |
2 |
12461 |
32.1 |
1.3 |
0.818 |
1 |
2 |
0 |
0.000 |
| 24 |
32 |
|
[ZN]B:503 |
1 |
1 |
98 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
6 |
2 |
12461 |
26.5 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.044 |
33 |
|
B |
5 |
2 |
12543 |
◊ |
[ZN]A:503 |
-x-1/2,-y,z-1/2 |
2_454 |
1 |
1 |
98 |
17.3 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.044 |
| Average: |
21.9 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.044 |
| 25 |
34 |
|
[CU]B:502 |
1 |
1 |
125 |
f |
[CU]B:501 |
x,y,z |
1_555 |
1 |
1 |
125 |
23.0 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.012 |
| 26 |
35 |
|
[CU]A:502 |
1 |
1 |
125 |
f |
[CU]A:501 |
x,y,z |
1_555 |
1 |
1 |
125 |
22.9 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.012 |
| 27 |
36 |
|
A |
6 |
3 |
12461 |
◊ |
[ZN]A:509 |
x-1,y,z |
1_455 |
1 |
1 |
98 |
21.4 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 28 |
37 |
|
[ZN]B:504 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
12461 |
18.8 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.019 |
| 29 |
38 |
|
[ZN]A:507 |
1 |
1 |
98 |
◊ |
[ZN]A:504 |
x,y,z |
1_555 |
1 |
1 |
98 |
0.3 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
|