## |
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 |
170 |
50 |
15570 |
◊ |
A |
x,y,z |
1_555 |
179 |
49 |
15489 |
1680.9 |
-23.1 |
0.067 |
18 |
3 |
0 |
0.214 |
2 |
2 |
|
[NAD]B:377 |
43 |
1 |
856 |
f |
B |
x,y,z |
1_555 |
78 |
36 |
15570 |
605.5 |
-6.6 |
0.567 |
14 |
0 |
0 |
0.193 |
3 |
|
[NAD]A:377 |
42 |
1 |
847 |
f |
A |
x,y,z |
1_555 |
72 |
36 |
15489 |
587.0 |
-8.9 |
0.335 |
15 |
0 |
0 |
0.193 |
Average: |
596.2 |
-7.7 |
0.451 |
15 |
0 |
0 |
0.193 |
3 |
4 |
|
A |
38 |
11 |
15489 |
◊ |
B |
x-1,y+1,z |
1_465 |
42 |
12 |
15570 |
327.6 |
-0.5 |
0.718 |
3 |
2 |
0 |
0.000 |
4 |
5 |
|
B |
24 |
9 |
15570 |
◊ |
A |
x-1,y,z-1 |
1_454 |
23 |
9 |
15489 |
216.8 |
-1.4 |
0.545 |
3 |
1 |
0 |
0.000 |
5 |
6 |
|
A |
15 |
7 |
15489 |
x |
A |
x,y-1,z |
1_545 |
17 |
5 |
15489 |
148.6 |
-1.0 |
0.497 |
1 |
0 |
0 |
0.000 |
6 |
7 |
|
[PYZ]B:378 |
6 |
1 |
245 |
f |
B |
x,y,z |
1_555 |
24 |
12 |
15570 |
132.4 |
0.5 |
0.205 |
2 |
0 |
0 |
0.007 |
8 |
|
[PYZ]A:378 |
6 |
1 |
242 |
f |
A |
x,y,z |
1_555 |
25 |
12 |
15489 |
128.7 |
0.3 |
0.194 |
2 |
0 |
0 |
0.007 |
Average: |
130.6 |
0.4 |
0.200 |
2 |
0 |
0 |
0.007 |
7 |
9 |
|
B |
9 |
3 |
15570 |
x |
B |
x,y-1,z |
1_545 |
12 |
5 |
15570 |
90.9 |
-0.6 |
0.554 |
0 |
0 |
0 |
0.000 |
8 |
10 |
|
[CL]B:601 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
15570 |
62.2 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.053 |
9 |
11 |
|
[PYZ]A:378 |
5 |
1 |
242 |
f |
[NAD]A:377 |
x,y,z |
1_555 |
9 |
1 |
847 |
50.6 |
0.3 |
0.247 |
0 |
0 |
0 |
0.000 |
12 |
|
[PYZ]B:378 |
3 |
1 |
245 |
f |
[NAD]B:377 |
x,y,z |
1_555 |
9 |
1 |
856 |
48.4 |
0.4 |
0.414 |
0 |
0 |
0 |
0.000 |
Average: |
49.5 |
0.3 |
0.330 |
0 |
0 |
0 |
0.000 |
10 |
13 |
|
[ZN]B:376 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
15570 |
30.5 |
-22.3 |
0.000 |
0 |
0 |
0 |
0.305 |
14 |
|
[ZN]A:376 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
5 |
15489 |
30.2 |
-22.6 |
0.000 |
0 |
0 |
0 |
0.305 |
Average: |
30.3 |
-22.4 |
0.000 |
0 |
0 |
0 |
0.305 |
11 |
15 |
|
[NAD]A:377 |
2 |
1 |
847 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
15570 |
27.3 |
-0.0 |
0.414 |
0 |
0 |
0 |
0.000 |
16 |
|
[NAD]B:377 |
2 |
1 |
856 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
15489 |
17.4 |
-0.1 |
0.410 |
0 |
0 |
0 |
0.000 |
Average: |
22.4 |
-0.1 |
0.412 |
0 |
0 |
0 |
0.001 |
12 |
17 |
|
[PYZ]B:378 |
3 |
1 |
245 |
f |
[ZN]B:376 |
x,y,z |
1_555 |
1 |
1 |
98 |
23.9 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.132 |
18 |
|
[PYZ]A:378 |
3 |
1 |
242 |
f |
[ZN]A:376 |
x,y,z |
1_555 |
1 |
1 |
98 |
23.0 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.132 |
Average: |
23.5 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.132 |
13 |
19 |
|
[NAD]A:377 |
3 |
1 |
847 |
f |
[ZN]A:376 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.3 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.099 |
20 |
|
[NAD]B:377 |
3 |
1 |
856 |
f |
[ZN]B:376 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.2 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.099 |
Average: |
20.2 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.099 |
14 |
21 |
|
B |
1 |
1 |
15570 |
◊ |
A |
x,y,z-1 |
1_554 |
1 |
1 |
15489 |
3.7 |
-0.1 |
0.380 |
0 |
0 |
0 |
0.000 |
15 |
22 |
|
[CL]B:601 |
1 |
1 |
125 |
◊ |
A |
x-1,y,z-1 |
1_454 |
1 |
1 |
15489 |
1.5 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
16 |
23 |
|
[PYZ]A:378 |
1 |
1 |
242 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
15570 |
0.7 |
-0.0 |
0.744 |
0 |
0 |
0 |
0.000 |
|