| ## |
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 |
121 |
35 |
13890 |
◊ |
A |
x,y,z |
1_555 |
115 |
34 |
14225 |
1106.4 |
-8.3 |
0.160 |
24 |
17 |
0 |
0.106 |
| 2 |
2 |
|
B |
38 |
13 |
13890 |
◊ |
A |
x-1,y,z |
1_455 |
42 |
15 |
14225 |
360.4 |
1.2 |
0.648 |
2 |
2 |
0 |
0.000 |
| 3 |
3 |
|
A |
29 |
12 |
14225 |
x |
A |
x-1,y,z |
1_455 |
35 |
10 |
14225 |
282.3 |
0.8 |
0.653 |
4 |
3 |
0 |
0.000 |
| 4 |
4 |
|
B |
32 |
11 |
13890 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
28 |
12 |
14225 |
269.5 |
1.3 |
0.668 |
5 |
2 |
0 |
0.000 |
| 5 |
5 |
|
B |
25 |
9 |
13890 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
25 |
8 |
14225 |
224.1 |
0.3 |
0.532 |
3 |
1 |
0 |
0.000 |
| 6 |
6 |
|
[OTD]A:410 |
13 |
1 |
314 |
f |
A |
x,y,z |
1_555 |
28 |
14 |
14225 |
179.1 |
-5.7 |
0.509 |
9 |
0 |
0 |
0.100 |
7 |
|
[OTD]B:410 |
13 |
1 |
319 |
f |
B |
x,y,z |
1_555 |
31 |
14 |
13890 |
173.2 |
-6.6 |
0.340 |
9 |
0 |
0 |
0.100 |
| Average: |
176.1 |
-6.1 |
0.424 |
9 |
0 |
0 |
0.100 |
| 7 |
8 |
|
B |
25 |
7 |
13890 |
x |
B |
-x,y-1/2,-z+1/2 |
3_545 |
20 |
8 |
13890 |
135.3 |
-0.4 |
0.513 |
0 |
0 |
0 |
0.000 |
| 8 |
9 |
|
A |
6 |
2 |
14225 |
x |
A |
x-1/2,-y+3/2,-z+1 |
4_466 |
11 |
4 |
14225 |
76.3 |
-1.2 |
0.204 |
1 |
0 |
0 |
0.000 |
| 9 |
10 |
|
[ZN]A:400 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
14225 |
32.8 |
-23.0 |
0.000 |
0 |
0 |
0 |
0.235 |
11 |
|
[ZN]B:401 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
13890 |
32.7 |
-24.5 |
0.000 |
0 |
0 |
0 |
0.235 |
| Average: |
32.8 |
-23.7 |
0.000 |
0 |
0 |
0 |
0.235 |
| 10 |
12 |
|
[ZN]B:400 |
1 |
1 |
98 |
cf |
B |
x,y,z |
1_555 |
7 |
4 |
13890 |
32.5 |
-24.3 |
0.000 |
0 |
0 |
0 |
0.237 |
13 |
|
[ZN]A:401 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
14225 |
32.0 |
-23.8 |
0.000 |
0 |
0 |
0 |
0.237 |
| Average: |
32.3 |
-24.0 |
0.000 |
0 |
0 |
0 |
0.237 |
| 11 |
14 |
|
[OTD]A:410 |
3 |
1 |
314 |
f |
[ZN]A:400 |
x,y,z |
1_555 |
1 |
1 |
98 |
27.4 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.124 |
15 |
|
[OTD]B:410 |
3 |
1 |
319 |
cf |
[ZN]B:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
26.4 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.124 |
| Average: |
26.9 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.124 |
| 12 |
16 |
|
[OTD]A:410 |
4 |
1 |
314 |
f |
[ZN]A:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
26.7 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.111 |
17 |
|
[OTD]B:410 |
3 |
1 |
319 |
f |
[ZN]B:400 |
x,y,z |
1_555 |
1 |
1 |
98 |
24.9 |
-11.0 |
0.000 |
0 |
0 |
0 |
0.111 |
| Average: |
25.8 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.111 |
| 13 |
18 |
|
[ZN]A:401 |
1 |
1 |
98 |
f |
[ZN]A:400 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.5 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.045 |
| 14 |
19 |
|
[ZN]B:401 |
1 |
1 |
98 |
f |
[ZN]B:400 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.6 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.042 |
|