## |
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 |
72 |
19 |
7240 |
◊ |
B |
x,y,z |
1_555 |
84 |
23 |
7094 |
756.3 |
-0.5 |
0.654 |
11 |
6 |
0 |
0.417 |
2 |
|
G |
73 |
19 |
7259 |
◊ |
E |
-x+1/2,y-1/2,-z |
4_545 |
84 |
24 |
7240 |
751.9 |
-1.2 |
0.599 |
13 |
5 |
0 |
0.417 |
3 |
|
L |
78 |
24 |
7159 |
◊ |
F |
x,y,z |
1_555 |
76 |
19 |
7337 |
747.3 |
-0.6 |
0.652 |
12 |
6 |
0 |
0.417 |
4 |
|
F |
79 |
23 |
7337 |
◊ |
D |
x-1/2,y-1/2,z |
3_445 |
72 |
20 |
7235 |
723.3 |
-0.4 |
0.659 |
11 |
4 |
0 |
0.417 |
5 |
|
L |
69 |
19 |
7159 |
◊ |
G |
-x,y,-z |
2_555 |
77 |
23 |
7259 |
721.9 |
-0.6 |
0.620 |
14 |
5 |
0 |
0.417 |
6 |
|
D |
79 |
23 |
7235 |
◊ |
B |
x,y,z |
1_555 |
70 |
19 |
7094 |
703.3 |
-0.4 |
0.660 |
9 |
4 |
0 |
0.417 |
7 |
|
K |
62 |
16 |
7094 |
◊ |
C |
-x+1/2,y-1/2,-z+1 |
4_546 |
70 |
22 |
7077 |
649.4 |
-1.0 |
0.541 |
11 |
4 |
0 |
0.417 |
8 |
|
I |
68 |
21 |
7026 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
54 |
15 |
7077 |
618.9 |
-1.9 |
0.464 |
13 |
4 |
0 |
0.417 |
9 |
|
J |
68 |
23 |
6884 |
◊ |
A |
x,y,z |
1_555 |
59 |
16 |
7147 |
604.4 |
-2.4 |
0.399 |
10 |
2 |
0 |
0.417 |
10 |
|
I |
59 |
17 |
7026 |
◊ |
A |
x,y,z |
1_555 |
68 |
22 |
7147 |
592.1 |
-2.9 |
0.357 |
9 |
2 |
0 |
0.417 |
11 |
|
K |
64 |
20 |
7094 |
◊ |
H |
x-1/2,y+1/2,z |
3_455 |
58 |
16 |
6950 |
583.1 |
-1.6 |
0.478 |
10 |
2 |
0 |
0.417 |
12 |
|
H |
65 |
20 |
6950 |
◊ |
J |
x,y-1,z |
1_545 |
56 |
15 |
6884 |
569.5 |
-2.9 |
0.348 |
9 |
2 |
0 |
0.417 |
Average: |
668.5 |
-1.4 |
0.536 |
11 |
4 |
0 |
0.417 |
2 |
13 |
|
L |
60 |
19 |
7159 |
◊ |
K |
x,y,z |
1_555 |
58 |
18 |
7094 |
610.6 |
-10.7 |
0.042 |
7 |
0 |
0 |
0.856 |
14 |
|
J |
58 |
18 |
6884 |
◊ |
E |
x,y,z |
1_555 |
60 |
20 |
7240 |
609.7 |
-12.3 |
0.018 |
8 |
0 |
0 |
0.856 |
15 |
|
B |
61 |
19 |
7094 |
◊ |
A |
x,y,z |
1_555 |
58 |
17 |
7147 |
608.6 |
-12.0 |
0.020 |
9 |
0 |
0 |
0.856 |
16 |
|
F |
62 |
19 |
7337 |
◊ |
C |
-x+1/2,y-1/2,-z+1 |
4_546 |
60 |
17 |
7077 |
607.8 |
-11.8 |
0.027 |
7 |
0 |
0 |
0.856 |
17 |
|
I |
57 |
17 |
7026 |
◊ |
D |
x,y,z |
1_555 |
60 |
19 |
7235 |
604.5 |
-10.3 |
0.047 |
8 |
0 |
0 |
0.856 |
18 |
|
H |
59 |
17 |
6950 |
◊ |
G |
-x+1/2,y-1/2,-z |
4_545 |
57 |
18 |
7259 |
596.8 |
-12.1 |
0.020 |
7 |
0 |
0 |
0.856 |
Average: |
606.3 |
-11.5 |
0.029 |
8 |
0 |
0 |
0.856 |
3 |
19 |
|
D |
38 |
12 |
7235 |
◊ |
D |
-x+1,y,-z |
2_655 |
38 |
12 |
7235 |
314.5 |
-0.8 |
0.566 |
2 |
0 |
0 |
0.000 |
4 |
20 |
|
D |
37 |
8 |
7235 |
◊ |
G |
-x+1/2,y-1/2,-z |
4_545 |
41 |
9 |
7259 |
307.9 |
-0.9 |
0.550 |
0 |
0 |
0 |
0.000 |
21 |
|
L |
41 |
9 |
7159 |
◊ |
B |
x,y,z |
1_555 |
38 |
8 |
7094 |
303.7 |
-1.2 |
0.534 |
1 |
0 |
0 |
0.000 |
22 |
|
F |
38 |
8 |
7337 |
◊ |
E |
x,y-1,z |
1_545 |
37 |
8 |
7240 |
296.9 |
-1.2 |
0.528 |
0 |
0 |
0 |
0.000 |
Average: |
302.8 |
-1.1 |
0.537 |
0 |
0 |
0 |
0.000 |
5 |
23 |
|
D |
30 |
11 |
7235 |
◊ |
B |
-x+1,y,-z |
2_655 |
32 |
10 |
7094 |
277.1 |
1.8 |
0.783 |
4 |
4 |
0 |
0.000 |
6 |
24 |
|
E |
33 |
12 |
7240 |
◊ |
A |
x,y,z |
1_555 |
31 |
10 |
7147 |
254.9 |
-0.9 |
0.524 |
1 |
0 |
0 |
0.036 |
25 |
|
L |
24 |
10 |
7159 |
◊ |
H |
x-1/2,y+1/2,z |
3_455 |
25 |
9 |
6950 |
219.1 |
-1.1 |
0.502 |
0 |
0 |
0 |
0.036 |
26 |
|
K |
28 |
11 |
7094 |
◊ |
F |
x,y,z |
1_555 |
29 |
13 |
7337 |
212.9 |
-0.9 |
0.535 |
0 |
0 |
0 |
0.036 |
27 |
|
I |
28 |
10 |
7026 |
◊ |
B |
x,y,z |
1_555 |
29 |
11 |
7094 |
205.3 |
-1.2 |
0.497 |
0 |
0 |
0 |
0.036 |
28 |
|
G |
25 |
10 |
7259 |
◊ |
J |
-x+1/2,y-1/2,-z |
4_545 |
25 |
9 |
6884 |
201.4 |
-1.3 |
0.486 |
0 |
0 |
0 |
0.036 |
29 |
|
D |
23 |
9 |
7235 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
23 |
8 |
7077 |
194.8 |
-0.8 |
0.512 |
1 |
0 |
0 |
0.036 |
Average: |
214.7 |
-1.0 |
0.509 |
0 |
0 |
0 |
0.036 |
7 |
30 |
|
L |
34 |
13 |
7159 |
◊ |
L |
-x,y,-z |
2_555 |
34 |
13 |
7159 |
252.5 |
0.1 |
0.633 |
8 |
0 |
0 |
0.000 |
8 |
31 |
|
G |
20 |
8 |
7259 |
◊ |
E |
x,y,z |
1_555 |
19 |
8 |
7240 |
181.7 |
1.2 |
0.740 |
4 |
5 |
0 |
0.000 |
9 |
32 |
|
K |
13 |
5 |
7094 |
◊ |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
13 |
5 |
7147 |
123.8 |
0.2 |
0.648 |
0 |
0 |
0 |
0.000 |
33 |
|
I |
13 |
5 |
7026 |
◊ |
C |
x,y,z |
1_555 |
13 |
5 |
7077 |
121.2 |
-0.1 |
0.605 |
0 |
0 |
0 |
0.000 |
34 |
|
H |
12 |
5 |
6950 |
◊ |
J |
-x+1,y-1,-z+1 |
2_646 |
13 |
5 |
6884 |
116.8 |
-0.2 |
0.603 |
0 |
0 |
0 |
0.000 |
Average: |
120.6 |
0.0 |
0.619 |
0 |
0 |
0 |
0.000 |
10 |
35 |
|
[ACT]B:201 |
4 |
1 |
181 |
f |
B |
x,y,z |
1_555 |
21 |
9 |
7094 |
107.2 |
-1.0 |
0.556 |
2 |
0 |
0 |
0.100 |
11 |
36 |
|
G |
22 |
9 |
7259 |
f |
[ACT]E:201 |
-x+1/2,y-1/2,-z |
4_545 |
4 |
1 |
182 |
106.7 |
-1.0 |
0.561 |
2 |
0 |
0 |
0.110 |
37 |
|
[ACT]F:201 |
4 |
1 |
182 |
f |
D |
x-1/2,y-1/2,z |
3_445 |
21 |
9 |
7235 |
104.9 |
-1.0 |
0.554 |
2 |
0 |
0 |
0.110 |
Average: |
105.8 |
-1.0 |
0.558 |
2 |
0 |
0 |
0.110 |
12 |
38 |
|
[ACT]K:201 |
4 |
1 |
182 |
f |
H |
x-1/2,y+1/2,z |
3_455 |
25 |
9 |
6950 |
105.7 |
-1.0 |
0.577 |
2 |
0 |
0 |
0.100 |
39 |
|
[ACT]A:201 |
4 |
1 |
180 |
f |
A |
x,y,z |
1_555 |
23 |
9 |
7147 |
105.7 |
-1.1 |
0.549 |
2 |
0 |
0 |
0.100 |
Average: |
105.7 |
-1.0 |
0.563 |
2 |
0 |
0 |
0.100 |
13 |
40 |
|
[ACT]I:201 |
4 |
1 |
182 |
f |
C |
-x+1,y,-z+1 |
2_656 |
21 |
9 |
7077 |
105.3 |
-0.9 |
0.564 |
2 |
0 |
0 |
0.101 |
14 |
41 |
|
K |
18 |
8 |
7094 |
◊ |
A |
x,y,z |
1_555 |
16 |
8 |
7147 |
100.9 |
2.0 |
0.808 |
0 |
0 |
0 |
0.000 |
42 |
|
C |
14 |
7 |
7077 |
◊ |
J |
-x+1/2,y-1/2,-z+1 |
4_546 |
13 |
7 |
6884 |
100.4 |
2.9 |
0.905 |
2 |
2 |
0 |
0.000 |
43 |
|
I |
12 |
7 |
7026 |
◊ |
H |
x,y,z |
1_555 |
14 |
7 |
6950 |
88.9 |
2.2 |
0.860 |
1 |
1 |
0 |
0.000 |
Average: |
96.7 |
2.4 |
0.858 |
1 |
1 |
0 |
0.000 |
15 |
44 |
|
[FMT]G:201 |
3 |
1 |
151 |
f |
L |
-x,y,-z |
2_555 |
21 |
9 |
7159 |
91.6 |
-0.4 |
0.369 |
2 |
0 |
0 |
0.100 |
16 |
45 |
|
[FMT]A:202 |
3 |
1 |
150 |
f |
I |
x,y,z |
1_555 |
24 |
9 |
7026 |
91.4 |
-0.6 |
0.365 |
2 |
0 |
0 |
0.100 |
46 |
|
[FMT]L:201 |
3 |
1 |
150 |
f |
F |
x,y,z |
1_555 |
22 |
9 |
7337 |
89.5 |
-0.5 |
0.370 |
2 |
0 |
0 |
0.100 |
Average: |
90.5 |
-0.5 |
0.367 |
2 |
0 |
0 |
0.100 |
17 |
47 |
|
[FMT]H:201 |
3 |
1 |
149 |
f |
J |
x,y-1,z |
1_545 |
22 |
9 |
6884 |
90.6 |
-0.4 |
0.376 |
2 |
0 |
0 |
0.100 |
18 |
48 |
|
[FMT]B:202 |
3 |
1 |
150 |
f |
E |
x,y,z |
1_555 |
22 |
9 |
7240 |
90.2 |
-0.5 |
0.365 |
2 |
0 |
0 |
0.100 |
49 |
|
K |
20 |
9 |
7094 |
f |
[FMT]C:201 |
-x+1/2,y-1/2,-z+1 |
4_546 |
3 |
1 |
150 |
88.7 |
-0.2 |
0.388 |
2 |
0 |
0 |
0.100 |
Average: |
89.5 |
-0.3 |
0.377 |
2 |
0 |
0 |
0.100 |
19 |
50 |
|
G |
9 |
3 |
7259 |
◊ |
F |
x,y,z |
1_555 |
6 |
2 |
7337 |
64.7 |
-0.1 |
0.510 |
0 |
0 |
0 |
0.000 |
20 |
51 |
|
L |
8 |
4 |
7159 |
◊ |
F |
-x,y,-z |
2_555 |
5 |
4 |
7337 |
43.7 |
-0.5 |
0.454 |
0 |
0 |
0 |
0.000 |
21 |
52 |
|
[ACT]F:201 |
4 |
1 |
182 |
◊ |
F |
x,y,z |
1_555 |
7 |
2 |
7337 |
41.8 |
1.0 |
0.891 |
2 |
0 |
0 |
0.000 |
53 |
|
[ACT]E:201 |
3 |
1 |
182 |
◊ |
E |
x,y,z |
1_555 |
5 |
1 |
7240 |
40.1 |
1.1 |
0.880 |
2 |
0 |
0 |
0.000 |
Average: |
41.0 |
1.0 |
0.886 |
2 |
0 |
0 |
0.000 |
22 |
54 |
|
[ACT]K:201 |
4 |
1 |
182 |
◊ |
K |
x,y,z |
1_555 |
6 |
2 |
7094 |
41.5 |
0.9 |
0.825 |
2 |
0 |
0 |
0.000 |
55 |
|
[ACT]I:201 |
4 |
1 |
182 |
◊ |
I |
x,y,z |
1_555 |
7 |
2 |
7026 |
40.8 |
0.9 |
0.822 |
2 |
0 |
0 |
0.000 |
56 |
|
[ACT]A:201 |
3 |
1 |
180 |
◊ |
J |
x,y,z |
1_555 |
5 |
1 |
6884 |
39.4 |
1.0 |
0.882 |
2 |
0 |
0 |
0.000 |
Average: |
40.6 |
0.9 |
0.843 |
2 |
0 |
0 |
0.000 |
23 |
57 |
|
[FMT]C:201 |
3 |
1 |
150 |
◊ |
C |
x,y,z |
1_555 |
7 |
2 |
7077 |
39.7 |
1.0 |
0.773 |
2 |
0 |
0 |
0.000 |
58 |
|
[FMT]B:202 |
3 |
1 |
150 |
◊ |
B |
x,y,z |
1_555 |
5 |
1 |
7094 |
39.3 |
1.0 |
0.787 |
2 |
0 |
0 |
0.000 |
Average: |
39.5 |
1.0 |
0.780 |
2 |
0 |
0 |
0.000 |
24 |
59 |
|
[FMT]A:202 |
3 |
1 |
150 |
◊ |
A |
x,y,z |
1_555 |
5 |
1 |
7147 |
39.6 |
0.9 |
0.775 |
2 |
0 |
0 |
0.000 |
60 |
|
[FMT]L:201 |
3 |
1 |
150 |
◊ |
L |
x,y,z |
1_555 |
7 |
1 |
7159 |
39.6 |
1.1 |
0.784 |
2 |
0 |
0 |
0.000 |
Average: |
39.6 |
1.0 |
0.779 |
2 |
0 |
0 |
0.000 |
25 |
61 |
|
[ACT]B:201 |
3 |
1 |
181 |
◊ |
D |
x,y,z |
1_555 |
7 |
1 |
7235 |
38.8 |
1.1 |
0.869 |
2 |
0 |
0 |
0.000 |
26 |
62 |
|
[FMT]H:201 |
3 |
1 |
149 |
◊ |
H |
x,y,z |
1_555 |
5 |
1 |
6950 |
38.8 |
1.1 |
0.796 |
2 |
0 |
0 |
0.000 |
63 |
|
[FMT]G:201 |
3 |
1 |
151 |
◊ |
G |
x,y,z |
1_555 |
6 |
1 |
7259 |
38.8 |
1.1 |
0.783 |
2 |
0 |
0 |
0.000 |
Average: |
38.8 |
1.1 |
0.790 |
2 |
0 |
0 |
0.000 |
27 |
64 |
|
L |
4 |
2 |
7159 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
7147 |
16.8 |
0.2 |
0.675 |
0 |
0 |
0 |
0.000 |
65 |
|
I |
3 |
2 |
7026 |
◊ |
G |
-x+1/2,y-1/2,-z |
4_545 |
4 |
2 |
7259 |
15.5 |
0.2 |
0.665 |
0 |
0 |
0 |
0.000 |
66 |
|
F |
4 |
2 |
7337 |
◊ |
J |
x,y-1,z |
1_545 |
3 |
2 |
6884 |
15.2 |
0.2 |
0.671 |
0 |
0 |
0 |
0.000 |
67 |
|
C |
2 |
2 |
7077 |
◊ |
E |
-x+1/2,y-1/2,-z+1 |
4_546 |
4 |
1 |
7240 |
15.1 |
0.2 |
0.695 |
0 |
0 |
0 |
0.000 |
68 |
|
H |
3 |
2 |
6950 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
7235 |
15.1 |
0.2 |
0.671 |
0 |
0 |
0 |
0.000 |
69 |
|
K |
2 |
2 |
7094 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
7094 |
14.3 |
0.2 |
0.697 |
0 |
0 |
0 |
0.000 |
Average: |
15.3 |
0.2 |
0.679 |
0 |
0 |
0 |
0.000 |
28 |
70 |
|
G |
1 |
1 |
7259 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
7094 |
2.0 |
-0.0 |
0.548 |
0 |
0 |
0 |
0.000 |
|