## |
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 |
136 |
34 |
11969 |
◊ |
C |
x,y,z |
1_555 |
134 |
35 |
12095 |
1258.5 |
-21.8 |
0.008 |
8 |
0 |
0 |
0.997 |
2 |
|
B |
134 |
36 |
12254 |
◊ |
A |
x,y,z |
1_555 |
137 |
37 |
12108 |
1257.4 |
-21.5 |
0.005 |
9 |
0 |
0 |
0.997 |
Average: |
1257.9 |
-21.7 |
0.007 |
9 |
0 |
0 |
0.997 |
2 |
3 |
|
D |
58 |
19 |
11969 |
◊ |
B |
x,y,z |
1_555 |
76 |
23 |
12254 |
641.4 |
-0.3 |
0.703 |
9 |
1 |
0 |
0.000 |
4 |
|
C |
62 |
19 |
12095 |
◊ |
A |
x,y,z |
1_555 |
59 |
19 |
12108 |
583.8 |
0.3 |
0.676 |
10 |
1 |
0 |
0.000 |
Average: |
612.6 |
0.0 |
0.689 |
10 |
1 |
0 |
0.000 |
3 |
5 |
|
C |
27 |
9 |
12095 |
◊ |
D |
x-1,y,z |
1_455 |
36 |
11 |
11969 |
282.3 |
2.3 |
0.824 |
6 |
8 |
0 |
0.000 |
4 |
6 |
|
A |
27 |
9 |
12108 |
◊ |
B |
-x,y-1/2,-z-1 |
2_544 |
25 |
6 |
12254 |
260.7 |
-0.9 |
0.390 |
3 |
4 |
0 |
0.000 |
5 |
7 |
|
A |
17 |
5 |
12108 |
x |
A |
-x,y-1/2,-z-1 |
2_544 |
25 |
7 |
12108 |
215.4 |
-1.3 |
0.429 |
2 |
6 |
0 |
0.000 |
6 |
8 |
|
C |
29 |
13 |
12095 |
◊ |
A |
x,y,z-1 |
1_554 |
24 |
11 |
12108 |
212.2 |
3.3 |
0.903 |
2 |
3 |
0 |
0.000 |
9 |
|
D |
18 |
10 |
11969 |
◊ |
B |
x,y,z-1 |
1_554 |
20 |
11 |
12254 |
133.4 |
1.1 |
0.777 |
1 |
1 |
0 |
0.000 |
Average: |
172.8 |
2.2 |
0.840 |
2 |
2 |
0 |
0.000 |
7 |
10 |
|
B |
23 |
7 |
12254 |
x |
B |
-x+1,y-1/2,-z-1 |
2_644 |
14 |
4 |
12254 |
164.2 |
-0.2 |
0.594 |
1 |
0 |
0 |
0.000 |
8 |
11 |
|
D |
14 |
6 |
11969 |
◊ |
B |
-x+1,y-1/2,-z-1 |
2_644 |
17 |
5 |
12254 |
133.6 |
0.7 |
0.684 |
2 |
1 |
0 |
0.000 |
9 |
12 |
|
A |
15 |
6 |
12108 |
◊ |
C |
-x,y-1/2,-z-2 |
2_543 |
14 |
4 |
12095 |
109.7 |
-1.0 |
0.435 |
0 |
0 |
0 |
0.000 |
10 |
13 |
|
[IOD]A:531 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
12108 |
91.6 |
0.3 |
0.797 |
0 |
0 |
0 |
0.000 |
11 |
14 |
|
[IOD]A:501 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
20 |
11 |
12108 |
88.9 |
1.1 |
0.899 |
0 |
0 |
0 |
0.000 |
15 |
|
[IOD]D:510 |
1 |
1 |
144 |
f |
D |
x,y,z |
1_555 |
15 |
10 |
11969 |
87.2 |
0.5 |
0.856 |
0 |
0 |
0 |
0.000 |
Average: |
88.1 |
0.8 |
0.877 |
0 |
0 |
0 |
0.000 |
12 |
16 |
|
[IOD]A:533 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
12108 |
88.5 |
-0.5 |
0.631 |
0 |
0 |
0 |
0.643 |
13 |
17 |
|
[IOD]C:523 |
1 |
1 |
144 |
f |
C |
x,y,z |
1_555 |
14 |
7 |
12095 |
83.2 |
0.4 |
0.806 |
0 |
0 |
0 |
0.000 |
18 |
|
[IOD]B:528 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
19 |
7 |
12254 |
81.6 |
0.3 |
0.805 |
0 |
0 |
0 |
0.000 |
Average: |
82.4 |
0.3 |
0.806 |
0 |
0 |
0 |
0.000 |
14 |
19 |
|
[IOD]A:513 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
12108 |
81.4 |
-0.5 |
0.581 |
0 |
0 |
0 |
0.662 |
15 |
20 |
|
[IOD]A:534 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
12108 |
78.3 |
-0.2 |
0.669 |
0 |
0 |
0 |
0.265 |
21 |
|
[IOD]B:535 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
12254 |
76.8 |
-0.3 |
0.655 |
0 |
0 |
0 |
0.265 |
Average: |
77.5 |
-0.3 |
0.662 |
0 |
0 |
0 |
0.265 |
16 |
22 |
|
[IOD]A:532 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
12108 |
73.9 |
0.2 |
0.793 |
0 |
0 |
0 |
0.000 |
17 |
23 |
|
[IOD]B:522 |
1 |
1 |
144 |
◊ |
B |
x,y,z |
1_555 |
11 |
5 |
12254 |
70.8 |
0.5 |
0.857 |
0 |
0 |
0 |
0.000 |
18 |
24 |
|
[IOD]B:515 |
1 |
1 |
144 |
◊ |
D |
x,y,z |
1_555 |
11 |
5 |
11969 |
65.0 |
0.3 |
0.842 |
0 |
0 |
0 |
0.000 |
19 |
25 |
|
C |
8 |
2 |
12095 |
◊ |
B |
x,y,z |
1_555 |
7 |
1 |
12254 |
64.1 |
0.5 |
0.722 |
0 |
0 |
0 |
0.000 |
26 |
|
D |
8 |
2 |
11969 |
◊ |
A |
x,y,z |
1_555 |
8 |
2 |
12108 |
63.5 |
0.7 |
0.774 |
0 |
0 |
0 |
0.000 |
Average: |
63.8 |
0.6 |
0.748 |
0 |
0 |
0 |
0.000 |
20 |
27 |
|
[IOD]A:530 |
1 |
1 |
144 |
◊ |
C |
x,y,z |
1_555 |
10 |
5 |
12095 |
62.4 |
-0.3 |
0.647 |
0 |
0 |
0 |
0.000 |
28 |
|
[IOD]A:530 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
9 |
5 |
12108 |
55.7 |
-0.3 |
0.641 |
0 |
0 |
0 |
0.000 |
Average: |
59.1 |
-0.3 |
0.644 |
0 |
0 |
0 |
0.000 |
21 |
29 |
|
[IOD]B:508 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
12254 |
62.3 |
-0.4 |
0.593 |
0 |
0 |
0 |
0.454 |
30 |
|
[IOD]A:502 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
12108 |
62.2 |
-0.3 |
0.637 |
0 |
0 |
0 |
0.454 |
31 |
|
[IOD]C:504 |
1 |
1 |
144 |
f |
C |
x,y,z |
1_555 |
10 |
5 |
12095 |
61.7 |
-0.3 |
0.618 |
0 |
0 |
0 |
0.454 |
32 |
|
[IOD]D:506 |
1 |
1 |
144 |
f |
D |
x,y,z |
1_555 |
11 |
5 |
11969 |
61.2 |
-0.3 |
0.647 |
0 |
0 |
0 |
0.454 |
Average: |
61.9 |
-0.3 |
0.624 |
0 |
0 |
0 |
0.454 |
22 |
33 |
|
A |
5 |
2 |
12108 |
◊ |
D |
x-1,y,z |
1_455 |
5 |
3 |
11969 |
55.5 |
0.6 |
0.768 |
1 |
3 |
0 |
0.000 |
23 |
34 |
|
[IOD]D:506 |
1 |
1 |
144 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
12095 |
55.1 |
-0.1 |
0.676 |
0 |
0 |
0 |
0.021 |
35 |
|
[IOD]B:508 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
12108 |
54.7 |
-0.3 |
0.618 |
0 |
0 |
0 |
0.021 |
36 |
|
[IOD]A:502 |
1 |
1 |
144 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
12254 |
54.3 |
-0.3 |
0.616 |
0 |
0 |
0 |
0.021 |
37 |
|
[IOD]C:504 |
1 |
1 |
144 |
◊ |
D |
x,y,z |
1_555 |
8 |
4 |
11969 |
54.1 |
-0.2 |
0.685 |
0 |
0 |
0 |
0.021 |
Average: |
54.6 |
-0.2 |
0.649 |
0 |
0 |
0 |
0.021 |
24 |
38 |
|
[IOD]B:515 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
12254 |
52.5 |
0.1 |
0.763 |
0 |
0 |
0 |
0.000 |
25 |
39 |
|
[IOD]D:520 |
1 |
1 |
144 |
◊ |
D |
x,y,z |
1_555 |
10 |
3 |
11969 |
50.2 |
-0.2 |
0.694 |
0 |
0 |
0 |
0.002 |
40 |
|
[IOD]D:520 |
1 |
1 |
144 |
◊ |
C |
x,y,z |
1_555 |
8 |
3 |
12095 |
47.0 |
-0.2 |
0.637 |
0 |
0 |
0 |
0.002 |
Average: |
48.6 |
-0.2 |
0.665 |
0 |
0 |
0 |
0.002 |
26 |
41 |
|
A |
6 |
4 |
12108 |
f |
[IOD]B:522 |
-x,y-1/2,-z-1 |
2_544 |
1 |
1 |
144 |
33.8 |
-0.4 |
0.507 |
0 |
0 |
0 |
0.510 |
27 |
42 |
|
[IOD]A:534 |
1 |
1 |
144 |
f |
[IOD]A:533 |
x,y,z |
1_555 |
1 |
1 |
144 |
31.0 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
28 |
43 |
|
C |
5 |
2 |
12095 |
◊ |
B |
x-1,y,z-1 |
1_454 |
2 |
2 |
12254 |
28.3 |
-0.4 |
0.267 |
0 |
0 |
0 |
0.000 |
29 |
44 |
|
C |
3 |
2 |
12095 |
x |
C |
-x,y-1/2,-z-2 |
2_543 |
2 |
2 |
12095 |
22.9 |
0.8 |
0.847 |
0 |
1 |
0 |
0.000 |
30 |
45 |
|
A |
1 |
1 |
12108 |
◊ |
B |
-x+1,y-1/2,-z-1 |
2_644 |
1 |
1 |
12254 |
14.3 |
-0.0 |
0.361 |
0 |
0 |
0 |
0.000 |
31 |
46 |
|
C |
2 |
1 |
12095 |
◊ |
B |
x,y,z-1 |
1_554 |
1 |
1 |
12254 |
10.7 |
0.0 |
0.567 |
0 |
0 |
0 |
0.000 |
47 |
|
D |
1 |
1 |
11969 |
◊ |
A |
x,y,z-1 |
1_554 |
2 |
1 |
12108 |
1.4 |
0.0 |
0.657 |
0 |
0 |
0 |
0.000 |
Average: |
6.1 |
0.0 |
0.612 |
0 |
0 |
0 |
0.000 |
32 |
48 |
|
[IOD]B:522 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
12108 |
6.9 |
-0.1 |
0.496 |
0 |
0 |
0 |
0.000 |
|