## |
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 |
|
D |
87 |
21 |
3211 |
◊ |
C |
x,y,z |
1_555 |
83 |
19 |
2045 |
832.3 |
-15.4 |
0.509 |
13 |
2 |
2 |
1.000 |
2 |
|
B |
91 |
21 |
3208 |
◊ |
A |
x,y,z |
1_555 |
80 |
20 |
2004 |
829.4 |
-16.0 |
0.475 |
9 |
2 |
2 |
1.000 |
Average: |
830.8 |
-15.7 |
0.492 |
11 |
2 |
2 |
1.000 |
2 |
3 |
|
D |
62 |
16 |
3211 |
◊ |
B |
x,y,z |
1_555 |
61 |
15 |
3208 |
578.9 |
-8.2 |
0.674 |
4 |
0 |
0 |
0.148 |
3 |
4 |
|
D |
57 |
15 |
3211 |
◊ |
B |
-y,x-y,z |
2_555 |
58 |
14 |
3208 |
519.8 |
-8.5 |
0.564 |
2 |
0 |
0 |
0.126 |
4 |
5 |
|
C |
18 |
5 |
2045 |
◊ |
A |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
21 |
6 |
2004 |
150.0 |
-0.4 |
0.848 |
1 |
0 |
0 |
0.000 |
5 |
6 |
|
C |
22 |
6 |
2045 |
◊ |
B |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
13 |
3 |
3208 |
143.8 |
-1.8 |
0.462 |
1 |
0 |
0 |
0.000 |
6 |
7 |
|
D |
16 |
3 |
3211 |
◊ |
A |
-y,x-y,z |
2_555 |
18 |
4 |
2004 |
139.6 |
-2.7 |
0.478 |
1 |
1 |
0 |
0.086 |
8 |
|
C |
19 |
4 |
2045 |
◊ |
B |
-y,x-y,z |
2_555 |
14 |
3 |
3208 |
128.3 |
-3.0 |
0.354 |
0 |
1 |
0 |
0.086 |
Average: |
134.0 |
-2.8 |
0.416 |
1 |
1 |
0 |
0.086 |
7 |
9 |
|
A |
10 |
4 |
2004 |
◊ |
D |
x,y,z-1 |
1_554 |
9 |
2 |
3211 |
99.6 |
-0.3 |
0.750 |
2 |
2 |
0 |
0.000 |
10 |
|
B |
1 |
1 |
3208 |
◊ |
C |
x,y,z-1 |
1_554 |
2 |
1 |
2045 |
18.5 |
0.9 |
0.882 |
0 |
0 |
0 |
0.000 |
Average: |
59.0 |
0.3 |
0.816 |
1 |
1 |
0 |
0.000 |
8 |
11 |
|
C |
7 |
4 |
2045 |
◊ |
B |
-y,x-y,z+1 |
2_556 |
9 |
3 |
3208 |
80.7 |
0.1 |
0.781 |
1 |
0 |
0 |
0.000 |
12 |
|
D |
4 |
1 |
3211 |
◊ |
A |
-y,x-y,z+1 |
2_556 |
3 |
2 |
2004 |
25.2 |
1.1 |
0.889 |
0 |
0 |
0 |
0.000 |
Average: |
53.0 |
0.6 |
0.835 |
1 |
0 |
0 |
0.000 |
9 |
13 |
|
C |
6 |
3 |
2045 |
◊ |
A |
-y,x-y,z+1 |
2_556 |
8 |
3 |
2004 |
79.6 |
-2.2 |
0.296 |
0 |
0 |
0 |
0.000 |
10 |
14 |
|
B |
8 |
3 |
3208 |
◊ |
D |
x,y,z-1 |
1_554 |
4 |
2 |
3211 |
60.0 |
1.4 |
0.905 |
1 |
0 |
0 |
0.000 |
11 |
15 |
|
[CL]B:102 |
1 |
1 |
125 |
fx |
[CL]B:102 |
-y,x-y,z |
2_555 |
1 |
1 |
125 |
57.4 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.139 |
12 |
16 |
|
D |
6 |
1 |
3211 |
◊ |
B |
-y,x-y,z+1 |
2_556 |
6 |
1 |
3208 |
47.9 |
-0.1 |
0.730 |
0 |
0 |
0 |
0.000 |
13 |
17 |
|
B |
5 |
2 |
3208 |
x |
B |
-y,x-y,z |
2_555 |
4 |
1 |
3208 |
47.3 |
-0.0 |
0.703 |
0 |
0 |
0 |
0.000 |
18 |
|
D |
3 |
1 |
3211 |
x |
D |
-y,x-y,z |
2_555 |
6 |
2 |
3211 |
44.7 |
0.1 |
0.744 |
0 |
0 |
0 |
0.000 |
Average: |
46.0 |
0.0 |
0.724 |
0 |
0 |
0 |
0.000 |
14 |
19 |
|
C |
5 |
2 |
2045 |
◊ |
A |
-y,x-y,z |
2_555 |
6 |
2 |
2004 |
44.0 |
-0.4 |
0.588 |
1 |
0 |
0 |
0.011 |
15 |
20 |
|
B |
6 |
4 |
3208 |
◊ |
C |
x,y,z |
1_555 |
4 |
1 |
2045 |
43.0 |
0.2 |
0.754 |
0 |
0 |
0 |
0.000 |
21 |
|
D |
4 |
3 |
3211 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
2004 |
40.0 |
0.1 |
0.689 |
0 |
0 |
0 |
0.000 |
Average: |
41.5 |
0.1 |
0.722 |
0 |
0 |
0 |
0.000 |
16 |
22 |
|
[ZN]D:101 |
1 |
1 |
98 |
fx |
[ZN]D:101 |
-y,x-y,z |
2_555 |
1 |
1 |
98 |
37.7 |
-30.2 |
0.000 |
0 |
0 |
0 |
0.348 |
17 |
23 |
|
A |
4 |
1 |
2004 |
x |
A |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
6 |
3 |
2004 |
33.4 |
0.2 |
0.762 |
0 |
0 |
0 |
0.000 |
18 |
24 |
|
[ZN]B:101 |
1 |
1 |
98 |
x |
B |
x,y,z |
1_555 |
4 |
2 |
3208 |
33.3 |
-16.6 |
0.000 |
0 |
0 |
0 |
0.450 |
25 |
|
[ZN]D:101 |
1 |
1 |
98 |
x |
D |
x,y,z |
1_555 |
3 |
1 |
3211 |
28.0 |
-13.0 |
0.000 |
0 |
0 |
0 |
0.450 |
Average: |
30.6 |
-14.8 |
0.000 |
0 |
0 |
0 |
0.450 |
19 |
26 |
|
A |
3 |
2 |
2004 |
◊ |
C |
x,y,z-1 |
1_554 |
5 |
2 |
2045 |
31.3 |
-0.4 |
0.602 |
0 |
0 |
0 |
0.000 |
20 |
27 |
|
[CL]B:102 |
1 |
1 |
125 |
fx |
[ZN]B:101 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.8 |
-14.9 |
0.000 |
0 |
0 |
0 |
0.363 |
21 |
28 |
|
[CL]D:102 |
1 |
1 |
125 |
fx |
[ZN]D:101 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.5 |
-14.1 |
0.000 |
0 |
0 |
0 |
0.163 |
22 |
29 |
|
D |
1 |
1 |
3211 |
◊ |
B |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
2 |
1 |
3208 |
27.2 |
0.4 |
0.536 |
0 |
0 |
0 |
0.000 |
23 |
30 |
|
[CL]D:102 |
1 |
1 |
125 |
x |
D |
x,y,z |
1_555 |
3 |
2 |
3211 |
26.9 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.095 |
31 |
|
[CL]B:102 |
1 |
1 |
125 |
x |
B |
x,y,z |
1_555 |
2 |
1 |
3208 |
20.4 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.095 |
Average: |
23.6 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.095 |
24 |
32 |
|
B |
2 |
1 |
3208 |
◊ |
D |
-y+2/3,x-y+1/3,z-2/3 |
5_554 |
3 |
1 |
3211 |
18.2 |
-0.1 |
0.651 |
0 |
0 |
0 |
0.000 |
25 |
33 |
|
D |
2 |
1 |
3211 |
◊ |
C |
x,y,z-1 |
1_554 |
5 |
3 |
2045 |
17.4 |
0.1 |
0.743 |
0 |
0 |
0 |
0.000 |
34 |
|
A |
2 |
2 |
2004 |
◊ |
B |
x,y,z-1 |
1_554 |
2 |
1 |
3208 |
1.4 |
-0.0 |
0.674 |
0 |
0 |
0 |
0.000 |
Average: |
9.4 |
0.0 |
0.709 |
0 |
0 |
0 |
0.000 |
26 |
35 |
|
B |
1 |
1 |
3208 |
◊ |
A |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
3 |
2 |
2004 |
6.9 |
0.2 |
0.775 |
0 |
0 |
0 |
0.000 |
27 |
36 |
|
D |
2 |
1 |
3211 |
◊ |
A |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
3 |
1 |
2004 |
3.5 |
0.0 |
0.682 |
0 |
0 |
0 |
0.000 |
|