## |
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 |
|
E |
93 |
22 |
9866 |
◊ |
D |
x,y,z |
1_555 |
90 |
23 |
9861 |
873.2 |
4.0 |
0.881 |
11 |
12 |
0 |
0.000 |
2 |
|
G |
86 |
23 |
9869 |
◊ |
F |
x,y,z |
1_555 |
91 |
22 |
9896 |
790.1 |
1.5 |
0.747 |
13 |
11 |
0 |
0.000 |
3 |
|
J |
87 |
21 |
9746 |
◊ |
I |
x,y,z |
1_555 |
87 |
22 |
9785 |
777.1 |
4.5 |
0.865 |
12 |
12 |
0 |
0.000 |
4 |
|
H |
85 |
22 |
9909 |
◊ |
A |
x,y,z |
1_555 |
83 |
22 |
9582 |
758.1 |
5.2 |
0.905 |
10 |
12 |
0 |
0.000 |
5 |
|
L |
80 |
19 |
9890 |
◊ |
K |
x,y,z |
1_555 |
73 |
20 |
9418 |
678.3 |
7.1 |
0.960 |
12 |
12 |
0 |
0.000 |
6 |
|
C |
78 |
20 |
9834 |
◊ |
B |
x,y,z |
1_555 |
78 |
21 |
9734 |
677.4 |
4.1 |
0.883 |
13 |
8 |
0 |
0.000 |
Average: |
759.0 |
4.4 |
0.874 |
12 |
11 |
0 |
0.000 |
2 |
7 |
|
F |
95 |
27 |
9896 |
◊ |
C |
x,y,z |
1_555 |
96 |
27 |
9834 |
833.5 |
-0.8 |
0.622 |
12 |
0 |
0 |
0.000 |
8 |
|
L |
90 |
26 |
9890 |
◊ |
A |
x,y,z |
1_555 |
92 |
27 |
9582 |
811.6 |
-1.5 |
0.614 |
14 |
0 |
0 |
0.000 |
9 |
|
I |
89 |
26 |
9785 |
◊ |
D |
x,y,z |
1_555 |
89 |
27 |
9861 |
797.8 |
-1.3 |
0.602 |
13 |
0 |
0 |
0.000 |
10 |
|
K |
89 |
26 |
9418 |
◊ |
H |
x,y,z |
1_555 |
91 |
27 |
9909 |
790.9 |
-0.5 |
0.656 |
13 |
0 |
0 |
0.000 |
11 |
|
J |
89 |
26 |
9746 |
◊ |
E |
x,y,z |
1_555 |
92 |
27 |
9866 |
782.6 |
-0.8 |
0.620 |
13 |
0 |
0 |
0.000 |
12 |
|
G |
92 |
26 |
9869 |
◊ |
B |
x,y,z |
1_555 |
88 |
26 |
9734 |
781.1 |
-0.7 |
0.646 |
12 |
0 |
0 |
0.000 |
Average: |
799.6 |
-0.9 |
0.627 |
13 |
0 |
0 |
0.000 |
3 |
13 |
|
H |
41 |
10 |
9909 |
◊ |
C |
x-1,y-1,z-1 |
1_444 |
41 |
9 |
9834 |
337.1 |
-0.9 |
0.542 |
1 |
0 |
0 |
0.000 |
14 |
|
F |
41 |
10 |
9896 |
◊ |
E |
x,y,z |
1_555 |
39 |
11 |
9866 |
321.1 |
-1.8 |
0.444 |
1 |
1 |
0 |
0.000 |
Average: |
329.1 |
-1.3 |
0.493 |
1 |
1 |
0 |
0.000 |
4 |
15 |
|
I |
33 |
9 |
9785 |
◊ |
G |
x-1,y-1,z-1 |
1_444 |
41 |
11 |
9869 |
328.4 |
2.2 |
0.774 |
6 |
3 |
0 |
0.000 |
16 |
|
E |
40 |
13 |
9866 |
◊ |
A |
x,y,z |
1_555 |
33 |
8 |
9582 |
319.7 |
1.5 |
0.738 |
5 |
6 |
0 |
0.000 |
17 |
|
H |
38 |
12 |
9909 |
◊ |
D |
x,y-1,z |
1_545 |
31 |
8 |
9861 |
312.3 |
1.1 |
0.687 |
5 |
5 |
0 |
0.000 |
18 |
|
L |
32 |
7 |
9890 |
◊ |
B |
x,y-1,z |
1_545 |
32 |
11 |
9734 |
306.1 |
-0.0 |
0.571 |
6 |
1 |
0 |
0.000 |
Average: |
316.6 |
1.2 |
0.692 |
6 |
4 |
0 |
0.000 |
5 |
19 |
|
I |
39 |
12 |
9785 |
◊ |
L |
x-1,y,z-1 |
1_454 |
37 |
12 |
9890 |
327.1 |
2.5 |
0.840 |
4 |
0 |
0 |
0.000 |
6 |
20 |
|
C |
30 |
10 |
9834 |
◊ |
F |
x-1,y,z |
1_455 |
29 |
10 |
9896 |
257.1 |
-0.3 |
0.576 |
2 |
1 |
0 |
0.000 |
7 |
21 |
|
I |
17 |
6 |
9785 |
◊ |
D |
x-1,y,z |
1_455 |
22 |
6 |
9861 |
157.4 |
-1.0 |
0.454 |
0 |
0 |
0 |
0.000 |
8 |
22 |
|
H |
11 |
5 |
9909 |
◊ |
K |
x-1,y,z |
1_455 |
11 |
4 |
9418 |
126.8 |
3.5 |
0.945 |
3 |
5 |
0 |
0.000 |
23 |
|
A |
12 |
4 |
9582 |
◊ |
L |
x-1,y,z |
1_455 |
11 |
4 |
9890 |
110.9 |
1.8 |
0.834 |
3 |
4 |
0 |
0.000 |
Average: |
118.8 |
2.7 |
0.890 |
3 |
5 |
0 |
0.000 |
9 |
24 |
|
J |
16 |
6 |
9746 |
◊ |
A |
x,y,z |
1_555 |
16 |
6 |
9582 |
126.7 |
2.1 |
0.841 |
1 |
2 |
0 |
0.000 |
10 |
25 |
|
D |
15 |
5 |
9861 |
◊ |
A |
x,y,z-1 |
1_554 |
20 |
6 |
9582 |
125.4 |
-1.5 |
0.314 |
0 |
2 |
0 |
0.000 |
11 |
26 |
|
C |
11 |
6 |
9834 |
◊ |
A |
x,y,z |
1_555 |
7 |
4 |
9582 |
90.6 |
2.3 |
0.741 |
1 |
0 |
0 |
0.000 |
27 |
|
I |
6 |
2 |
9785 |
◊ |
C |
x-1,y,z-1 |
1_454 |
6 |
2 |
9834 |
67.5 |
2.1 |
0.861 |
0 |
1 |
0 |
0.000 |
28 |
|
L |
7 |
3 |
9890 |
◊ |
F |
x,y,z |
1_555 |
6 |
3 |
9896 |
54.5 |
0.9 |
0.796 |
1 |
2 |
0 |
0.000 |
29 |
|
D |
5 |
4 |
9861 |
◊ |
F |
x-1,y,z-1 |
1_454 |
9 |
4 |
9896 |
42.5 |
0.9 |
0.772 |
1 |
1 |
0 |
0.000 |
Average: |
63.8 |
1.5 |
0.792 |
1 |
1 |
0 |
0.000 |
12 |
30 |
|
J |
16 |
6 |
9746 |
◊ |
C |
x,y,z |
1_555 |
9 |
3 |
9834 |
87.3 |
-0.9 |
0.389 |
0 |
0 |
0 |
0.000 |
31 |
|
K |
9 |
5 |
9418 |
◊ |
F |
x-1,y-1,z-1 |
1_444 |
9 |
3 |
9896 |
58.8 |
-0.6 |
0.473 |
0 |
0 |
0 |
0.000 |
Average: |
73.1 |
-0.7 |
0.431 |
0 |
0 |
0 |
0.000 |
13 |
32 |
|
J |
9 |
5 |
9746 |
◊ |
L |
x-1,y,z |
1_455 |
12 |
4 |
9890 |
80.9 |
0.1 |
0.495 |
0 |
0 |
0 |
0.000 |
14 |
33 |
|
K |
9 |
5 |
9418 |
◊ |
D |
x,y-1,z |
1_545 |
10 |
3 |
9861 |
68.3 |
0.3 |
0.543 |
0 |
1 |
0 |
0.000 |
34 |
|
L |
6 |
2 |
9890 |
◊ |
G |
x,y-1,z |
1_545 |
9 |
4 |
9869 |
65.2 |
0.8 |
0.724 |
0 |
2 |
0 |
0.000 |
35 |
|
I |
6 |
2 |
9785 |
◊ |
B |
x-1,y-1,z-1 |
1_444 |
7 |
3 |
9734 |
42.8 |
0.2 |
0.567 |
0 |
0 |
0 |
0.000 |
Average: |
58.8 |
0.4 |
0.611 |
0 |
1 |
0 |
0.000 |
15 |
36 |
|
[CU]B:301 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
9734 |
62.7 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.069 |
37 |
|
[CU]L:301 |
1 |
1 |
125 |
f |
L |
x,y,z |
1_555 |
9 |
5 |
9890 |
62.3 |
-10.4 |
0.000 |
0 |
0 |
0 |
0.069 |
38 |
|
[CU]H:301 |
1 |
1 |
125 |
f |
H |
x,y,z |
1_555 |
9 |
5 |
9909 |
61.9 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.069 |
39 |
|
[CU]D:301 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
9 |
5 |
9861 |
61.7 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.069 |
40 |
|
[CU]F:301 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
9 |
5 |
9896 |
61.4 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.069 |
41 |
|
[CU]C:301 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
7 |
3 |
9834 |
60.3 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.069 |
42 |
|
[CU]J:301 |
1 |
1 |
125 |
f |
J |
x,y,z |
1_555 |
6 |
5 |
9746 |
59.9 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.069 |
43 |
|
[CU]K:301 |
1 |
1 |
125 |
f |
K |
x,y,z |
1_555 |
8 |
4 |
9418 |
59.9 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.069 |
44 |
|
[CU]G:301 |
1 |
1 |
125 |
f |
G |
x,y,z |
1_555 |
9 |
5 |
9869 |
59.9 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.069 |
45 |
|
[CU]I:301 |
1 |
1 |
125 |
f |
I |
x,y,z |
1_555 |
9 |
5 |
9785 |
59.6 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.069 |
46 |
|
[CU]A:301 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
9582 |
59.4 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.069 |
47 |
|
[CU]E:301 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
9 |
4 |
9866 |
59.4 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.069 |
Average: |
60.7 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.069 |
16 |
48 |
|
[CU]C:302 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
7 |
3 |
9834 |
48.2 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.036 |
49 |
|
[CU]H:302 |
1 |
1 |
125 |
f |
H |
x,y,z |
1_555 |
4 |
2 |
9909 |
48.1 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.036 |
50 |
|
[CU]J:302 |
1 |
1 |
125 |
f |
J |
x,y,z |
1_555 |
3 |
2 |
9746 |
47.8 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.036 |
51 |
|
[CU]L:302 |
1 |
1 |
125 |
cf |
L |
x,y,z |
1_555 |
5 |
3 |
9890 |
47.3 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.036 |
52 |
|
[CU]E:302 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
4 |
2 |
9866 |
46.7 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.036 |
53 |
|
[CU]D:302 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
4 |
2 |
9861 |
46.6 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.036 |
54 |
|
[CU]F:302 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
6 |
3 |
9896 |
46.5 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.036 |
55 |
|
[CU]A:302 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
9582 |
45.6 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.036 |
56 |
|
[CU]B:302 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
9734 |
45.3 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.036 |
57 |
|
[CU]K:302 |
1 |
1 |
125 |
f |
K |
x,y,z |
1_555 |
5 |
3 |
9418 |
44.5 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.036 |
58 |
|
[CU]I:302 |
1 |
1 |
125 |
f |
I |
x,y,z |
1_555 |
4 |
2 |
9785 |
44.4 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.036 |
59 |
|
[CU]G:302 |
1 |
1 |
125 |
f |
G |
x,y,z |
1_555 |
6 |
3 |
9869 |
43.3 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.036 |
Average: |
46.2 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.036 |
17 |
60 |
|
[CU]A:302 |
1 |
1 |
125 |
◊ |
J |
x,y,z |
1_555 |
3 |
1 |
9746 |
21.6 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.000 |
61 |
|
K |
3 |
1 |
9418 |
◊ |
[CU]D:302 |
x,y-1,z |
1_545 |
1 |
1 |
125 |
14.4 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.000 |
62 |
|
[CU]L:302 |
1 |
1 |
125 |
◊ |
G |
x,y-1,z |
1_545 |
1 |
1 |
9869 |
8.0 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.000 |
63 |
|
[CU]I:302 |
1 |
1 |
125 |
◊ |
B |
x-1,y-1,z-1 |
1_444 |
1 |
1 |
9734 |
6.3 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
12.5 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.000 |
18 |
64 |
|
A |
4 |
1 |
9582 |
◊ |
B |
x,y-1,z |
1_545 |
3 |
2 |
9734 |
13.1 |
0.0 |
0.610 |
0 |
0 |
0 |
0.000 |
65 |
|
D |
4 |
1 |
9861 |
◊ |
G |
x-1,y-1,z-1 |
1_444 |
3 |
2 |
9869 |
11.5 |
-0.0 |
0.607 |
0 |
0 |
0 |
0.000 |
66 |
|
H |
3 |
3 |
9909 |
◊ |
I |
x,y-1,z |
1_545 |
4 |
2 |
9785 |
7.2 |
0.1 |
0.648 |
0 |
0 |
0 |
0.000 |
67 |
|
L |
2 |
1 |
9890 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
9866 |
3.1 |
0.1 |
0.712 |
0 |
0 |
0 |
0.000 |
Average: |
8.7 |
0.0 |
0.644 |
0 |
0 |
0 |
0.000 |
19 |
68 |
|
K |
1 |
1 |
9418 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
9582 |
3.9 |
0.1 |
0.787 |
0 |
0 |
0 |
0.000 |
69 |
|
J |
1 |
1 |
9746 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
9861 |
2.3 |
0.1 |
0.745 |
0 |
0 |
0 |
0.000 |
70 |
|
I |
1 |
1 |
9785 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
9866 |
2.3 |
0.1 |
0.747 |
0 |
0 |
0 |
0.000 |
71 |
|
L |
1 |
1 |
9890 |
◊ |
H |
x,y,z |
1_555 |
1 |
1 |
9909 |
0.2 |
0.0 |
0.637 |
0 |
0 |
0 |
0.000 |
Average: |
2.2 |
0.0 |
0.729 |
0 |
0 |
0 |
0.000 |
20 |
72 |
|
I |
3 |
1 |
9785 |
◊ |
E |
x-1,y,z |
1_455 |
1 |
1 |
9866 |
2.7 |
0.1 |
0.708 |
0 |
0 |
0 |
0.000 |
21 |
73 |
|
J |
1 |
1 |
9746 |
◊ |
H |
x,y,z |
1_555 |
1 |
1 |
9909 |
2.3 |
0.1 |
0.771 |
0 |
0 |
0 |
0.000 |
22 |
74 |
|
K |
2 |
1 |
9418 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
9866 |
1.6 |
-0.0 |
0.532 |
0 |
0 |
0 |
0.000 |
|