| ## |
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 |
|
F |
87 |
25 |
8226 |
◊ |
C |
x,y,z |
1_555 |
85 |
24 |
8681 |
871.7 |
-0.7 |
0.764 |
13 |
2 |
0 |
0.000 |
2 |
|
I |
78 |
23 |
8175 |
◊ |
L |
x-1/2,y-3/2,z-1 |
3_434 |
77 |
21 |
8039 |
825.5 |
-1.7 |
0.737 |
7 |
1 |
0 |
0.000 |
| Average: |
848.6 |
-1.2 |
0.751 |
10 |
2 |
0 |
0.000 |
| 2 |
3 |
|
I |
67 |
17 |
8175 |
◊ |
H |
x,y,z |
1_555 |
87 |
19 |
8712 |
750.3 |
-11.0 |
0.054 |
3 |
0 |
0 |
1.000 |
4 |
|
C |
65 |
18 |
8681 |
◊ |
B |
x,y,z |
1_555 |
86 |
21 |
8822 |
746.5 |
-9.5 |
0.137 |
4 |
2 |
0 |
1.000 |
5 |
|
L |
64 |
17 |
8039 |
◊ |
K |
x,y,z |
1_555 |
79 |
17 |
9155 |
732.4 |
-11.0 |
0.050 |
4 |
2 |
0 |
1.000 |
6 |
|
F |
64 |
17 |
8226 |
◊ |
E |
x,y,z |
1_555 |
85 |
22 |
8721 |
718.3 |
-10.0 |
0.071 |
4 |
2 |
0 |
1.000 |
| Average: |
736.9 |
-10.4 |
0.078 |
4 |
2 |
0 |
1.000 |
| 3 |
7 |
|
V |
68 |
21 |
4673 |
◊ |
U |
x,y,z |
1_555 |
68 |
20 |
4817 |
681.4 |
-15.0 |
0.047 |
1 |
0 |
0 |
1.000 |
8 |
|
T |
70 |
20 |
5373 |
◊ |
S |
x,y,z |
1_555 |
62 |
20 |
5074 |
654.2 |
-14.7 |
0.049 |
3 |
0 |
0 |
1.000 |
| Average: |
667.8 |
-14.9 |
0.048 |
2 |
0 |
0 |
1.000 |
| 4 |
9 |
|
S |
65 |
18 |
5074 |
◊ |
B |
x,y,z |
1_555 |
73 |
17 |
8822 |
659.3 |
-4.4 |
0.584 |
3 |
2 |
0 |
0.000 |
10 |
|
T |
68 |
19 |
5373 |
◊ |
H |
x,y,z |
1_555 |
64 |
16 |
8712 |
647.2 |
-2.4 |
0.714 |
5 |
5 |
0 |
0.000 |
11 |
|
U |
63 |
17 |
4817 |
◊ |
E |
x,y,z |
1_555 |
66 |
16 |
8721 |
591.8 |
-3.9 |
0.551 |
3 |
0 |
0 |
0.000 |
12 |
|
V |
63 |
18 |
4673 |
◊ |
K |
x,y,z |
1_555 |
64 |
16 |
9155 |
558.4 |
-6.3 |
0.422 |
2 |
0 |
0 |
0.000 |
| Average: |
614.1 |
-4.3 |
0.568 |
3 |
2 |
0 |
0.000 |
| 5 |
13 |
|
H |
36 |
10 |
8712 |
◊ |
K |
x-1/2,y-3/2,z-1 |
3_434 |
41 |
10 |
9155 |
401.0 |
1.0 |
0.813 |
7 |
4 |
0 |
0.000 |
14 |
|
E |
36 |
10 |
8721 |
◊ |
B |
x,y,z |
1_555 |
39 |
12 |
8822 |
393.4 |
0.3 |
0.742 |
6 |
4 |
0 |
0.000 |
| Average: |
397.2 |
0.6 |
0.778 |
7 |
4 |
0 |
0.000 |
| 6 |
15 |
|
C |
37 |
16 |
8681 |
◊ |
C |
-x,y,-z |
2_555 |
38 |
17 |
8681 |
378.3 |
-2.5 |
0.503 |
0 |
0 |
0 |
0.000 |
| 7 |
16 |
|
C |
32 |
10 |
8681 |
◊ |
B |
-x,y,-z |
2_555 |
21 |
7 |
8822 |
256.6 |
-1.0 |
0.437 |
3 |
0 |
0 |
0.000 |
| 8 |
17 |
|
T |
26 |
8 |
5373 |
◊ |
C |
-x,y-1,-z |
2_545 |
26 |
10 |
8681 |
210.2 |
-0.0 |
0.726 |
1 |
1 |
0 |
0.000 |
| 9 |
18 |
|
L |
20 |
9 |
8039 |
◊ |
E |
-x,y,-z+1 |
2_556 |
26 |
7 |
8721 |
207.0 |
1.6 |
0.825 |
3 |
4 |
0 |
0.000 |
| 10 |
19 |
|
H |
20 |
5 |
8712 |
◊ |
C |
-x,y-1,-z |
2_545 |
32 |
11 |
8681 |
193.5 |
-1.6 |
0.531 |
0 |
0 |
0 |
0.000 |
| 11 |
20 |
|
U |
27 |
9 |
4817 |
◊ |
L |
-x,y,-z+1 |
2_556 |
18 |
6 |
8039 |
158.5 |
-1.5 |
0.493 |
0 |
0 |
0 |
0.000 |
| 12 |
21 |
|
S |
18 |
6 |
5074 |
◊ |
C |
-x,y,-z |
2_555 |
18 |
8 |
8681 |
146.2 |
1.1 |
0.733 |
0 |
0 |
0 |
0.000 |
| 13 |
22 |
|
V |
18 |
5 |
4673 |
◊ |
V |
-x,y,-z+1 |
2_556 |
18 |
5 |
4673 |
142.7 |
2.2 |
0.893 |
0 |
0 |
0 |
0.000 |
| 14 |
23 |
|
B |
11 |
6 |
8822 |
◊ |
F |
x,y-1,z |
1_545 |
12 |
4 |
8226 |
124.8 |
-1.0 |
0.351 |
0 |
0 |
0 |
0.000 |
| 15 |
24 |
|
B |
11 |
4 |
8822 |
◊ |
L |
-x,y-1,-z+1 |
2_546 |
10 |
3 |
8039 |
100.3 |
-0.7 |
0.516 |
1 |
0 |
0 |
0.000 |
| 16 |
25 |
|
S |
11 |
4 |
5074 |
◊ |
F |
-x,y-1,-z |
2_545 |
9 |
5 |
8226 |
90.5 |
-1.1 |
0.448 |
0 |
0 |
0 |
0.000 |
| 17 |
26 |
|
H |
8 |
3 |
8712 |
◊ |
B |
-x-1/2,y-1/2,-z |
4_445 |
6 |
2 |
8822 |
65.9 |
0.3 |
0.668 |
1 |
0 |
0 |
0.000 |
| 18 |
27 |
|
H |
11 |
5 |
8712 |
◊ |
E |
-x,y-1,-z |
2_545 |
6 |
3 |
8721 |
63.8 |
-0.4 |
0.587 |
0 |
0 |
0 |
0.000 |
| 19 |
28 |
|
I |
5 |
1 |
8175 |
◊ |
T |
x,y-1,z |
1_545 |
9 |
3 |
5373 |
61.0 |
1.1 |
0.834 |
1 |
2 |
0 |
0.000 |
| 20 |
29 |
|
T |
10 |
5 |
5373 |
◊ |
F |
-x,y-1,-z |
2_545 |
7 |
2 |
8226 |
56.4 |
0.2 |
0.670 |
0 |
0 |
0 |
0.000 |
| 21 |
30 |
|
L |
5 |
4 |
8039 |
◊ |
F |
-x,y,-z+1 |
2_556 |
3 |
2 |
8226 |
55.3 |
-0.7 |
0.242 |
0 |
0 |
0 |
0.000 |
| 22 |
31 |
|
H |
4 |
1 |
8712 |
◊ |
E |
-x-1/2,y-1/2,-z |
4_445 |
4 |
2 |
8721 |
41.8 |
0.8 |
0.844 |
1 |
0 |
0 |
0.000 |
| 23 |
32 |
|
I |
2 |
1 |
8175 |
◊ |
E |
-x-1/2,y-3/2,-z |
4_435 |
4 |
1 |
8721 |
30.5 |
-0.4 |
0.327 |
0 |
0 |
0 |
0.000 |
| 24 |
33 |
|
I |
2 |
1 |
8175 |
◊ |
B |
-x-1/2,y-1/2,-z |
4_445 |
3 |
1 |
8822 |
25.5 |
-0.1 |
0.408 |
0 |
0 |
0 |
0.000 |
| 25 |
34 |
|
I |
2 |
1 |
8175 |
◊ |
K |
x-1/2,y-3/2,z-1 |
3_434 |
1 |
1 |
9155 |
8.0 |
-0.0 |
0.445 |
0 |
0 |
0 |
0.000 |
35 |
|
C |
1 |
1 |
8681 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
8721 |
6.6 |
0.0 |
0.485 |
0 |
0 |
0 |
0.000 |
36 |
|
F |
1 |
1 |
8226 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
8822 |
4.1 |
-0.0 |
0.516 |
0 |
0 |
0 |
0.000 |
| Average: |
6.2 |
-0.0 |
0.482 |
0 |
0 |
0 |
0.000 |
| 26 |
37 |
|
B |
1 |
1 |
8822 |
◊ |
B |
-x,y,-z |
2_555 |
1 |
1 |
8822 |
4.8 |
0.1 |
0.784 |
0 |
0 |
0 |
0.000 |
| 27 |
38 |
|
I |
1 |
1 |
8175 |
◊ |
B |
-x-1/2,y-3/2,-z |
4_435 |
1 |
1 |
8822 |
4.4 |
-0.1 |
0.362 |
0 |
0 |
0 |
0.000 |
| 28 |
39 |
|
I |
1 |
1 |
8175 |
◊ |
C |
-x,y-1,-z |
2_545 |
1 |
1 |
8681 |
1.2 |
0.0 |
0.614 |
0 |
0 |
0 |
0.000 |
| 29 |
40 |
|
H |
1 |
1 |
8712 |
◊ |
F |
-x,y-1,-z |
2_545 |
1 |
1 |
8226 |
0.4 |
0.0 |
0.641 |
0 |
0 |
0 |
0.000 |
| 30 |
41 |
|
I |
1 |
1 |
8175 |
◊ |
H |
x,y-1,z |
1_545 |
1 |
1 |
8712 |
0.2 |
-0.0 |
0.625 |
0 |
0 |
0 |
0.000 |
|