## |
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 |
76 |
22 |
9325 |
x |
B |
-x-1,y-1/2,-z-1 |
2_444 |
76 |
19 |
9325 |
700.2 |
0.2 |
0.582 |
4 |
0 |
0 |
0.000 |
2 |
2 |
|
D |
39 |
6 |
890 |
◊ |
A |
x,y,z |
1_555 |
89 |
32 |
9469 |
560.4 |
-6.2 |
0.373 |
9 |
3 |
0 |
0.208 |
3 |
|
C |
40 |
6 |
894 |
◊ |
B |
x,y,z |
1_555 |
89 |
30 |
9325 |
555.0 |
-6.9 |
0.341 |
9 |
1 |
0 |
0.208 |
Average: |
557.7 |
-6.6 |
0.357 |
9 |
2 |
0 |
0.208 |
3 |
4 |
|
A |
55 |
15 |
9469 |
x |
A |
-x,y-1/2,-z |
2_545 |
60 |
15 |
9469 |
510.2 |
0.6 |
0.547 |
3 |
0 |
0 |
0.000 |
4 |
5 |
|
B |
35 |
10 |
9325 |
x |
B |
x,y-1,z |
1_545 |
44 |
13 |
9325 |
345.6 |
0.3 |
0.588 |
0 |
0 |
0 |
0.000 |
5 |
6 |
|
B |
39 |
12 |
9325 |
◊ |
A |
x-1,y,z |
1_455 |
28 |
10 |
9469 |
285.4 |
-1.2 |
0.406 |
0 |
0 |
0 |
0.000 |
6 |
7 |
|
B |
30 |
10 |
9325 |
x |
B |
x-1,y,z |
1_455 |
31 |
9 |
9325 |
280.5 |
-1.9 |
0.295 |
0 |
0 |
0 |
0.000 |
7 |
8 |
|
A |
32 |
10 |
9469 |
x |
A |
x,y-1,z |
1_545 |
28 |
12 |
9469 |
257.2 |
-0.1 |
0.536 |
0 |
0 |
0 |
0.000 |
8 |
9 |
|
B |
28 |
6 |
9325 |
◊ |
A |
x,y,z |
1_555 |
29 |
8 |
9469 |
243.8 |
-0.3 |
0.528 |
3 |
0 |
0 |
0.000 |
9 |
10 |
|
[LPD]D:125 |
8 |
1 |
264 |
◊ |
A |
x,y,z |
1_555 |
28 |
9 |
9469 |
145.5 |
-2.3 |
0.361 |
0 |
0 |
0 |
0.042 |
11 |
|
[LPD]C:125 |
8 |
1 |
263 |
◊ |
B |
x,y,z |
1_555 |
31 |
9 |
9325 |
130.4 |
-2.0 |
0.388 |
0 |
0 |
0 |
0.042 |
Average: |
138.0 |
-2.1 |
0.374 |
0 |
0 |
0 |
0.042 |
10 |
12 |
|
A |
14 |
4 |
9469 |
x |
A |
x-1,y,z |
1_455 |
13 |
3 |
9469 |
125.7 |
-1.4 |
0.240 |
0 |
0 |
0 |
0.000 |
11 |
13 |
|
[LPD]D:125 |
7 |
1 |
264 |
cf |
D |
x,y,z |
1_555 |
6 |
3 |
890 |
62.9 |
-0.6 |
0.633 |
0 |
0 |
0 |
0.080 |
14 |
|
[LPD]C:125 |
7 |
1 |
263 |
cf |
C |
x,y,z |
1_555 |
6 |
3 |
894 |
58.1 |
-0.6 |
0.624 |
0 |
0 |
0 |
0.080 |
Average: |
60.5 |
-0.6 |
0.628 |
0 |
0 |
0 |
0.080 |
12 |
15 |
|
[ACE]D:118 |
3 |
1 |
171 |
cf |
D |
x,y,z |
1_555 |
6 |
2 |
890 |
62.3 |
-0.2 |
0.843 |
0 |
0 |
0 |
0.020 |
13 |
16 |
|
[ACE]C:118 |
3 |
1 |
172 |
cf |
C |
x,y,z |
1_555 |
5 |
2 |
894 |
62.1 |
-0.2 |
0.830 |
0 |
0 |
0 |
0.022 |
14 |
17 |
|
[LPD]C:125 |
5 |
1 |
263 |
◊ |
A |
x-1,y,z |
1_455 |
7 |
2 |
9469 |
55.3 |
-0.6 |
0.433 |
0 |
0 |
0 |
0.000 |
15 |
18 |
|
[ACE]C:118 |
3 |
1 |
172 |
◊ |
B |
x-1,y,z |
1_455 |
5 |
2 |
9325 |
53.1 |
-0.8 |
0.584 |
0 |
0 |
0 |
0.000 |
16 |
19 |
|
A |
5 |
1 |
9469 |
◊ |
D |
x-1,y,z |
1_455 |
6 |
2 |
890 |
51.2 |
-0.3 |
0.638 |
0 |
0 |
0 |
0.000 |
17 |
20 |
|
[ACE]D:118 |
3 |
1 |
171 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
9469 |
46.9 |
-0.4 |
0.708 |
0 |
0 |
0 |
0.008 |
18 |
21 |
|
[ACE]C:118 |
3 |
1 |
172 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
9325 |
42.8 |
-0.1 |
0.815 |
0 |
0 |
0 |
0.002 |
19 |
22 |
|
A |
5 |
1 |
9469 |
◊ |
[ACE]D:118 |
x-1,y,z |
1_455 |
3 |
1 |
171 |
37.3 |
-0.4 |
0.532 |
0 |
0 |
0 |
0.000 |
20 |
23 |
|
[ZN]B:301 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
9325 |
36.4 |
-23.6 |
0.000 |
0 |
0 |
0 |
0.456 |
24 |
|
[ZN]A:301 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
9469 |
35.8 |
-24.3 |
0.000 |
0 |
0 |
0 |
0.456 |
Average: |
36.1 |
-23.9 |
0.000 |
0 |
0 |
0 |
0.456 |
21 |
25 |
|
C |
4 |
2 |
894 |
◊ |
B |
x-1,y,z |
1_455 |
5 |
2 |
9325 |
34.8 |
-0.7 |
0.380 |
0 |
0 |
0 |
0.000 |
22 |
26 |
|
[ZN]B:301 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
7 |
4 |
894 |
34.4 |
-15.5 |
0.000 |
0 |
0 |
0 |
0.292 |
27 |
|
[ZN]A:301 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
8 |
4 |
890 |
33.0 |
-14.8 |
0.000 |
0 |
0 |
0 |
0.292 |
Average: |
33.7 |
-15.1 |
0.000 |
0 |
0 |
0 |
0.292 |
23 |
28 |
|
B |
2 |
2 |
9325 |
◊ |
[LPD]D:125 |
x-1,y,z |
1_455 |
4 |
1 |
264 |
19.5 |
0.1 |
0.749 |
0 |
0 |
0 |
0.000 |
24 |
29 |
|
B |
3 |
2 |
9325 |
x |
B |
-x-2,y-1/2,-z-1 |
2_344 |
4 |
2 |
9325 |
12.8 |
-0.3 |
0.461 |
0 |
0 |
0 |
0.000 |
25 |
30 |
|
C |
4 |
1 |
894 |
◊ |
B |
-x-2,y-1/2,-z-1 |
2_344 |
1 |
1 |
9325 |
8.8 |
-0.1 |
0.413 |
0 |
0 |
0 |
0.000 |
26 |
31 |
|
[ACE]C:118 |
2 |
1 |
172 |
◊ |
B |
-x-2,y-1/2,-z-1 |
2_344 |
1 |
1 |
9325 |
7.5 |
-0.2 |
0.478 |
0 |
0 |
0 |
0.000 |
|