| ## |
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 |
|
C |
52 |
17 |
10164 |
◊ |
B |
x,y,z |
1_555 |
57 |
20 |
10162 |
505.5 |
-7.1 |
0.136 |
5 |
0 |
0 |
0.000 |
2 |
|
B |
46 |
15 |
10162 |
◊ |
A |
x,y,z |
1_555 |
52 |
17 |
10132 |
468.0 |
-7.7 |
0.075 |
2 |
0 |
0 |
0.000 |
3 |
|
D |
53 |
18 |
10218 |
◊ |
A |
x,y,z |
1_555 |
51 |
17 |
10132 |
445.7 |
-8.5 |
0.060 |
0 |
0 |
0 |
0.000 |
4 |
|
D |
51 |
17 |
10218 |
◊ |
C |
x,y,z |
1_555 |
51 |
19 |
10164 |
433.5 |
-8.1 |
0.070 |
1 |
0 |
0 |
0.000 |
| Average: |
463.2 |
-7.8 |
0.085 |
2 |
0 |
0 |
0.000 |
| 2 |
5 |
|
A |
48 |
15 |
10132 |
◊ |
C |
x-1,y,z |
1_455 |
43 |
13 |
10164 |
360.1 |
0.6 |
0.770 |
5 |
6 |
0 |
0.000 |
6 |
|
D |
29 |
10 |
10218 |
◊ |
B |
x,y-1,z |
1_545 |
42 |
14 |
10162 |
308.4 |
-0.1 |
0.651 |
0 |
0 |
0 |
0.000 |
| Average: |
334.3 |
0.3 |
0.711 |
3 |
3 |
0 |
0.000 |
| 3 |
7 |
|
C |
36 |
11 |
10164 |
◊ |
B |
y,x,-z |
7_555 |
38 |
10 |
10162 |
329.7 |
0.8 |
0.724 |
6 |
1 |
0 |
0.000 |
8 |
|
D |
37 |
11 |
10218 |
◊ |
A |
y,x,-z |
7_555 |
36 |
10 |
10132 |
319.5 |
-0.5 |
0.640 |
5 |
2 |
0 |
0.000 |
| Average: |
324.6 |
0.1 |
0.682 |
6 |
2 |
0 |
0.000 |
| 4 |
9 |
|
A |
32 |
11 |
10132 |
◊ |
B |
-x+1/2,y-1/2,-z+1/4 |
5_545 |
39 |
14 |
10162 |
325.6 |
-1.7 |
0.492 |
1 |
2 |
0 |
0.060 |
| 5 |
10 |
|
D |
30 |
7 |
10218 |
◊ |
C |
y,x-1,-z |
7_545 |
33 |
8 |
10164 |
265.1 |
-0.3 |
0.632 |
3 |
0 |
0 |
0.000 |
| 6 |
11 |
|
D |
26 |
10 |
10218 |
◊ |
C |
x,y-1,z |
1_545 |
20 |
7 |
10164 |
227.1 |
0.8 |
0.710 |
3 |
0 |
0 |
0.000 |
12 |
|
B |
21 |
6 |
10162 |
◊ |
C |
x-1,y,z |
1_455 |
21 |
8 |
10164 |
182.9 |
0.6 |
0.722 |
2 |
0 |
0 |
0.000 |
| Average: |
205.0 |
0.7 |
0.716 |
3 |
0 |
0 |
0.000 |
| 7 |
13 |
|
[PBZ]C:302 |
10 |
1 |
299 |
◊ |
C |
x,y,z |
1_555 |
36 |
16 |
10164 |
206.3 |
4.8 |
0.438 |
4 |
0 |
0 |
0.000 |
14 |
|
[PBZ]B:301 |
10 |
1 |
300 |
◊ |
B |
x,y,z |
1_555 |
36 |
17 |
10162 |
199.2 |
4.8 |
0.433 |
5 |
0 |
0 |
0.000 |
| Average: |
202.7 |
4.8 |
0.436 |
5 |
0 |
0 |
0.000 |
| 8 |
15 |
|
[PBZ]D:304 |
10 |
1 |
303 |
◊ |
D |
x,y,z |
1_555 |
37 |
17 |
10218 |
205.0 |
4.5 |
0.449 |
4 |
0 |
0 |
0.000 |
| 9 |
16 |
|
[PBZ]A:303 |
10 |
1 |
300 |
◊ |
A |
x,y,z |
1_555 |
34 |
17 |
10132 |
203.9 |
5.1 |
0.499 |
4 |
0 |
0 |
0.000 |
| 10 |
17 |
|
A |
17 |
6 |
10132 |
◊ |
D |
x-1,y,z |
1_455 |
15 |
6 |
10218 |
141.6 |
-0.2 |
0.618 |
2 |
0 |
0 |
0.000 |
18 |
|
A |
12 |
5 |
10132 |
◊ |
B |
x,y-1,z |
1_545 |
19 |
9 |
10162 |
120.9 |
-0.3 |
0.608 |
1 |
0 |
0 |
0.000 |
| Average: |
131.3 |
-0.2 |
0.613 |
2 |
0 |
0 |
0.000 |
| 11 |
19 |
|
A |
10 |
7 |
10132 |
◊ |
A |
y,x,-z |
7_555 |
10 |
7 |
10132 |
102.5 |
0.1 |
0.672 |
0 |
0 |
0 |
0.000 |
20 |
|
C |
15 |
9 |
10164 |
◊ |
C |
y,x,-z |
7_555 |
15 |
9 |
10164 |
95.7 |
-0.2 |
0.623 |
0 |
0 |
0 |
0.000 |
21 |
|
D |
15 |
7 |
10218 |
◊ |
B |
y,x,-z |
7_555 |
17 |
8 |
10162 |
90.4 |
0.8 |
0.746 |
0 |
0 |
0 |
0.000 |
| Average: |
96.2 |
0.2 |
0.681 |
0 |
0 |
0 |
0.000 |
| 12 |
22 |
|
[ZN]A:401 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
10132 |
35.9 |
-20.8 |
0.000 |
0 |
0 |
0 |
0.504 |
| 13 |
23 |
|
[ZN]A:401 |
1 |
1 |
98 |
◊ |
B |
-x+1/2,y-1/2,-z+1/4 |
5_545 |
6 |
2 |
10162 |
35.6 |
-18.6 |
0.000 |
0 |
0 |
0 |
0.449 |
| 14 |
24 |
|
[PBZ]C:302 |
4 |
1 |
299 |
f |
B |
x,y,z |
1_555 |
6 |
2 |
10162 |
31.2 |
0.2 |
0.042 |
0 |
0 |
0 |
0.000 |
25 |
|
[PBZ]B:301 |
4 |
1 |
300 |
f |
A |
x,y,z |
1_555 |
3 |
2 |
10132 |
21.2 |
0.3 |
0.025 |
0 |
0 |
0 |
0.000 |
| Average: |
26.2 |
0.3 |
0.033 |
0 |
0 |
0 |
0.000 |
| 15 |
26 |
|
[PBZ]A:303 |
4 |
1 |
300 |
f |
D |
x,y,z |
1_555 |
4 |
2 |
10218 |
29.5 |
0.7 |
0.033 |
1 |
0 |
0 |
0.000 |
| 16 |
27 |
|
[PBZ]D:304 |
4 |
1 |
303 |
f |
C |
x,y,z |
1_555 |
2 |
1 |
10164 |
22.1 |
0.4 |
0.028 |
0 |
0 |
0 |
0.000 |
| 17 |
28 |
|
C |
1 |
1 |
10164 |
◊ |
B |
-x+3/2,y-1/2,-z+1/4 |
5_645 |
1 |
1 |
10162 |
2.4 |
-0.0 |
0.557 |
0 |
0 |
0 |
0.000 |
|