| ## |
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 |
97 |
33 |
7840 |
◊ |
A |
x,y,z |
1_555 |
114 |
32 |
8097 |
961.4 |
-9.2 |
0.287 |
11 |
4 |
0 |
0.260 |
2 |
|
C |
111 |
32 |
7930 |
◊ |
A |
x,y,z |
1_555 |
94 |
34 |
8097 |
938.7 |
-8.3 |
0.313 |
12 |
4 |
0 |
0.260 |
3 |
|
C |
101 |
31 |
7930 |
◊ |
B |
x,y,z |
1_555 |
102 |
31 |
7840 |
893.9 |
-6.4 |
0.458 |
9 |
3 |
0 |
0.260 |
| Average: |
931.3 |
-8.0 |
0.353 |
11 |
4 |
0 |
0.260 |
| 2 |
4 |
|
C |
36 |
11 |
7930 |
◊ |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
41 |
10 |
8097 |
333.4 |
-3.5 |
0.400 |
4 |
1 |
0 |
0.000 |
| 3 |
5 |
|
B |
31 |
9 |
7840 |
x |
B |
-x+1/2,y-1/2,-z |
4_545 |
40 |
10 |
7840 |
307.1 |
-3.5 |
0.366 |
1 |
0 |
0 |
0.000 |
| 4 |
6 |
|
C |
26 |
7 |
7930 |
◊ |
A |
x,y-1,z |
1_545 |
32 |
11 |
8097 |
282.2 |
-1.3 |
0.468 |
2 |
1 |
0 |
0.000 |
| 5 |
7 |
|
[F01]C:903 |
16 |
1 |
397 |
f |
C |
x,y,z |
1_555 |
31 |
11 |
7930 |
203.9 |
3.0 |
0.449 |
8 |
0 |
0 |
0.008 |
8 |
|
[F01]A:901 |
18 |
1 |
395 |
f |
A |
x,y,z |
1_555 |
31 |
11 |
8097 |
202.9 |
3.0 |
0.364 |
7 |
0 |
0 |
0.008 |
9 |
|
[F01]B:902 |
16 |
1 |
393 |
f |
B |
x,y,z |
1_555 |
28 |
11 |
7840 |
198.1 |
2.5 |
0.368 |
7 |
0 |
0 |
0.008 |
| Average: |
201.6 |
2.8 |
0.393 |
7 |
0 |
0 |
0.008 |
| 6 |
10 |
|
A |
25 |
7 |
8097 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
25 |
7 |
8097 |
192.8 |
-1.9 |
0.464 |
0 |
0 |
0 |
0.000 |
| 7 |
11 |
|
[GPP]C:904 |
14 |
1 |
500 |
◊ |
C |
x,y,z |
1_555 |
20 |
9 |
7930 |
168.4 |
-0.6 |
0.399 |
3 |
0 |
0 |
0.012 |
| 8 |
12 |
|
[GPP]C:904 |
14 |
1 |
500 |
◊ |
A |
x,y,z |
1_555 |
18 |
9 |
8097 |
150.3 |
-1.4 |
0.398 |
4 |
0 |
0 |
0.021 |
| 9 |
13 |
|
[GPP]C:904 |
14 |
1 |
500 |
f |
B |
x,y,z |
1_555 |
17 |
9 |
7840 |
139.4 |
-2.7 |
0.353 |
3 |
0 |
0 |
0.026 |
| 10 |
14 |
|
B |
11 |
4 |
7840 |
◊ |
B |
-x+1,y,-z |
2_655 |
11 |
4 |
7840 |
112.4 |
-0.7 |
0.538 |
0 |
0 |
0 |
0.000 |
| 11 |
15 |
|
C |
11 |
3 |
7930 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
11 |
3 |
7930 |
100.4 |
-1.8 |
0.329 |
0 |
0 |
0 |
0.000 |
| 12 |
16 |
|
[F01]B:902 |
7 |
1 |
393 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
8097 |
68.7 |
1.1 |
0.388 |
0 |
0 |
0 |
0.000 |
17 |
|
[F01]A:901 |
7 |
1 |
395 |
◊ |
C |
x,y,z |
1_555 |
6 |
3 |
7930 |
57.1 |
1.0 |
0.392 |
0 |
0 |
0 |
0.000 |
18 |
|
[F01]C:903 |
6 |
1 |
397 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
7840 |
50.3 |
1.0 |
0.427 |
0 |
0 |
0 |
0.000 |
| Average: |
58.7 |
1.0 |
0.402 |
0 |
0 |
0 |
0.000 |
| 13 |
19 |
|
[ZN]A:801 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
8097 |
50.0 |
-34.0 |
0.000 |
0 |
0 |
0 |
0.669 |
20 |
|
[ZN]C:803 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
7930 |
49.8 |
-34.6 |
0.000 |
0 |
0 |
0 |
0.669 |
21 |
|
[ZN]B:802 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
7840 |
49.7 |
-33.9 |
0.000 |
0 |
0 |
0 |
0.669 |
| Average: |
49.8 |
-34.2 |
0.000 |
0 |
0 |
0 |
0.669 |
| 14 |
22 |
|
B |
4 |
2 |
7840 |
◊ |
A |
x,y-1,z |
1_545 |
7 |
3 |
8097 |
25.9 |
0.0 |
0.659 |
1 |
0 |
0 |
0.000 |
| 15 |
23 |
|
[ZN]B:802 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
7930 |
5.7 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.024 |
24 |
|
[ZN]C:803 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
8097 |
3.5 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.024 |
25 |
|
[ZN]A:801 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
7840 |
0.4 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.024 |
| Average: |
3.2 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.024 |
|