## |
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 |
80 |
13 |
1883 |
◊ |
B |
x,y,z |
1_555 |
112 |
34 |
17442 |
845.6 |
-6.6 |
0.443 |
10 |
7 |
0 |
0.326 |
2 |
|
C |
79 |
14 |
1810 |
◊ |
A |
x,y,z |
1_555 |
112 |
33 |
17653 |
827.3 |
-7.1 |
0.395 |
11 |
8 |
0 |
0.326 |
Average: |
836.5 |
-6.8 |
0.419 |
11 |
8 |
0 |
0.326 |
2 |
3 |
|
B |
88 |
25 |
17442 |
◊ |
A |
x,y,z |
1_555 |
85 |
25 |
17653 |
659.4 |
-0.4 |
0.621 |
7 |
0 |
0 |
0.000 |
3 |
4 |
|
B |
62 |
17 |
17442 |
◊ |
B |
y,x,-z+1 |
7_556 |
62 |
17 |
17442 |
544.1 |
3.9 |
0.896 |
16 |
0 |
0 |
0.000 |
4 |
5 |
|
A |
51 |
18 |
17653 |
◊ |
B |
-x+1/2,y-1/2,-z+3/4 |
5_545 |
49 |
18 |
17442 |
445.3 |
-1.7 |
0.436 |
2 |
0 |
0 |
0.000 |
5 |
6 |
|
A |
50 |
17 |
17653 |
◊ |
A |
y,x,-z+1 |
7_556 |
49 |
17 |
17653 |
434.4 |
-0.7 |
0.533 |
4 |
4 |
0 |
0.000 |
6 |
7 |
|
B |
45 |
20 |
17442 |
◊ |
B |
y,x,-z |
7_555 |
45 |
20 |
17442 |
416.7 |
-1.9 |
0.426 |
2 |
0 |
0 |
0.000 |
8 |
|
A |
37 |
16 |
17653 |
◊ |
A |
y,x,-z |
7_555 |
36 |
16 |
17653 |
346.9 |
-2.3 |
0.314 |
2 |
0 |
0 |
0.000 |
Average: |
381.8 |
-2.1 |
0.370 |
2 |
0 |
0 |
0.000 |
7 |
9 |
|
B |
34 |
10 |
17442 |
◊ |
A |
-y+1/2,x+1/2,z-1/4 |
3_554 |
41 |
12 |
17653 |
324.2 |
1.5 |
0.702 |
5 |
0 |
0 |
0.000 |
8 |
10 |
|
D |
15 |
4 |
1883 |
◊ |
A |
x,y,z |
1_555 |
15 |
4 |
17653 |
124.7 |
-0.2 |
0.590 |
2 |
0 |
0 |
0.000 |
11 |
|
C |
13 |
5 |
1810 |
◊ |
B |
x,y,z |
1_555 |
11 |
5 |
17442 |
93.1 |
-1.2 |
0.507 |
1 |
0 |
0 |
0.000 |
Average: |
108.9 |
-0.7 |
0.549 |
2 |
0 |
0 |
0.000 |
9 |
12 |
|
D |
14 |
5 |
1883 |
◊ |
A |
y,x,-z+1 |
7_556 |
7 |
2 |
17653 |
102.7 |
0.4 |
0.753 |
1 |
0 |
0 |
0.000 |
10 |
13 |
|
A |
10 |
5 |
17653 |
◊ |
B |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
10 |
2 |
17442 |
90.1 |
-1.6 |
0.181 |
0 |
0 |
0 |
0.000 |
11 |
14 |
|
[ACE]C:0 |
3 |
1 |
172 |
cf |
C |
x,y,z |
1_555 |
8 |
3 |
1810 |
87.2 |
-1.9 |
0.662 |
1 |
0 |
0 |
0.172 |
12 |
15 |
|
[ACE]D:0 |
3 |
1 |
170 |
cf |
D |
x,y,z |
1_555 |
7 |
3 |
1883 |
85.8 |
-1.9 |
0.636 |
0 |
0 |
0 |
0.102 |
13 |
16 |
|
A |
12 |
5 |
17653 |
◊ |
B |
-y+1/2,x-1/2,z-1/4 |
3_544 |
15 |
5 |
17442 |
85.0 |
-0.0 |
0.586 |
0 |
0 |
0 |
0.000 |
14 |
17 |
|
B |
10 |
5 |
17442 |
◊ |
A |
y,x,-z |
7_555 |
8 |
4 |
17653 |
72.5 |
1.4 |
0.828 |
0 |
0 |
0 |
0.000 |
15 |
18 |
|
[CL]B:501 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
7 |
17442 |
65.6 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.333 |
19 |
|
[CL]A:501 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
7 |
17653 |
65.6 |
-13.5 |
0.000 |
0 |
0 |
0 |
0.333 |
Average: |
65.6 |
-12.9 |
0.000 |
0 |
0 |
0 |
0.333 |
16 |
20 |
|
[NH2]C:19 |
1 |
1 |
117 |
cf |
C |
x,y,z |
1_555 |
5 |
3 |
1810 |
57.5 |
1.0 |
0.821 |
0 |
0 |
0 |
0.000 |
17 |
21 |
|
[NH2]D:19 |
1 |
1 |
117 |
cf |
D |
x,y,z |
1_555 |
3 |
1 |
1883 |
48.9 |
0.0 |
0.472 |
0 |
0 |
0 |
0.000 |
18 |
22 |
|
[CA]B:502 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
9 |
8 |
17442 |
45.6 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.323 |
23 |
|
[CA]A:502 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
9 |
8 |
17653 |
45.2 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.323 |
Average: |
45.4 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.323 |
19 |
24 |
|
B |
6 |
1 |
17442 |
◊ |
B |
-y+1,-x+1,-z+1/2 |
8_665 |
6 |
1 |
17442 |
20.7 |
-0.2 |
0.517 |
0 |
0 |
0 |
0.000 |
20 |
25 |
|
[ACE]D:0 |
2 |
1 |
170 |
◊ |
A |
y,x,-z+1 |
7_556 |
5 |
2 |
17653 |
17.2 |
0.3 |
0.763 |
0 |
0 |
0 |
0.000 |
21 |
26 |
|
[NH2]D:19 |
1 |
1 |
117 |
◊ |
A |
y,x,-z+1 |
7_556 |
1 |
1 |
17653 |
3.5 |
0.1 |
0.860 |
0 |
0 |
0 |
0.000 |
22 |
27 |
|
[NH2]D:19 |
1 |
1 |
117 |
◊ |
C |
y,x,-z+1 |
7_556 |
1 |
1 |
1810 |
2.5 |
-0.0 |
0.707 |
0 |
0 |
0 |
0.000 |
|