## |
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 |
|
B |
213 |
58 |
12680 |
◊ |
A |
x,y,z |
1_555 |
212 |
58 |
12727 |
2177.9 |
-40.5 |
0.001 |
9 |
0 |
0 |
0.801 |
2 |
|
H |
217 |
59 |
12777 |
◊ |
G |
x,y,z |
1_555 |
210 |
56 |
12627 |
2151.1 |
-41.2 |
0.001 |
11 |
2 |
0 |
0.801 |
3 |
|
F |
208 |
57 |
12652 |
◊ |
E |
x,y,z |
1_555 |
210 |
56 |
12621 |
2150.7 |
-40.2 |
0.000 |
13 |
1 |
0 |
0.801 |
4 |
|
N |
216 |
59 |
12687 |
◊ |
M |
x,y,z |
1_555 |
212 |
58 |
12702 |
2147.2 |
-40.0 |
0.001 |
13 |
1 |
0 |
0.801 |
5 |
|
D |
208 |
57 |
12716 |
◊ |
C |
x,y,z |
1_555 |
203 |
57 |
12738 |
2142.8 |
-38.2 |
0.001 |
17 |
2 |
0 |
0.801 |
6 |
|
J |
210 |
58 |
12683 |
◊ |
I |
x,y,z |
1_555 |
204 |
56 |
12641 |
2070.6 |
-41.6 |
0.000 |
10 |
0 |
0 |
0.801 |
Average: |
2140.1 |
-40.3 |
0.001 |
12 |
1 |
0 |
0.801 |
2 |
7 |
|
P |
128 |
31 |
7899 |
◊ |
O |
x,y,z |
1_555 |
131 |
33 |
7820 |
1297.2 |
-23.5 |
0.010 |
6 |
1 |
0 |
0.620 |
3 |
8 |
|
L |
120 |
29 |
7751 |
◊ |
K |
x,y,z |
1_555 |
116 |
31 |
7783 |
1213.7 |
-25.0 |
0.003 |
5 |
0 |
0 |
0.627 |
4 |
9 |
|
O |
63 |
16 |
7820 |
◊ |
N |
x,y,z |
1_555 |
62 |
16 |
12687 |
630.9 |
-9.1 |
0.124 |
2 |
0 |
0 |
0.004 |
5 |
10 |
|
P |
57 |
17 |
7899 |
◊ |
J |
x,y,z |
1_555 |
57 |
17 |
12683 |
618.4 |
-8.0 |
0.142 |
5 |
2 |
0 |
0.018 |
6 |
11 |
|
H |
62 |
17 |
12777 |
◊ |
C |
x,y,z |
1_555 |
57 |
14 |
12738 |
613.7 |
-8.6 |
0.123 |
3 |
0 |
0 |
0.000 |
7 |
12 |
|
D |
60 |
16 |
12716 |
◊ |
B |
x,y,z |
1_555 |
58 |
15 |
12680 |
601.0 |
-9.5 |
0.090 |
1 |
0 |
0 |
0.000 |
8 |
13 |
|
L |
62 |
15 |
7751 |
◊ |
M |
x,y,z |
1_555 |
57 |
15 |
12702 |
562.4 |
-8.6 |
0.128 |
5 |
1 |
0 |
0.048 |
9 |
14 |
|
K |
55 |
16 |
7783 |
◊ |
I |
x,y,z |
1_555 |
56 |
18 |
12641 |
555.8 |
-7.3 |
0.166 |
3 |
2 |
0 |
0.004 |
10 |
15 |
|
F |
62 |
19 |
12652 |
◊ |
A |
x,y,z |
1_555 |
56 |
15 |
12727 |
555.5 |
-7.5 |
0.161 |
3 |
1 |
0 |
0.000 |
11 |
16 |
|
G |
53 |
17 |
12627 |
◊ |
E |
x,y,z |
1_555 |
52 |
16 |
12621 |
542.2 |
-6.6 |
0.198 |
3 |
3 |
0 |
0.000 |
12 |
17 |
|
[ADP]F:601 |
27 |
1 |
567 |
f |
F |
x,y,z |
1_555 |
49 |
24 |
12652 |
365.3 |
-5.5 |
0.466 |
6 |
0 |
0 |
0.226 |
18 |
|
[ADP]D:601 |
27 |
1 |
569 |
f |
D |
x,y,z |
1_555 |
44 |
22 |
12716 |
353.0 |
-5.0 |
0.464 |
5 |
0 |
0 |
0.226 |
19 |
|
[ADP]A:601 |
27 |
1 |
563 |
f |
A |
x,y,z |
1_555 |
48 |
23 |
12727 |
350.4 |
-4.1 |
0.492 |
5 |
0 |
0 |
0.226 |
20 |
|
[ADP]E:601 |
27 |
1 |
567 |
f |
E |
x,y,z |
1_555 |
48 |
23 |
12621 |
349.8 |
-4.2 |
0.488 |
4 |
0 |
0 |
0.226 |
Average: |
354.6 |
-4.7 |
0.477 |
5 |
0 |
0 |
0.226 |
13 |
21 |
|
[ADP]C:601 |
27 |
1 |
570 |
f |
C |
x,y,z |
1_555 |
47 |
24 |
12738 |
357.9 |
-5.3 |
0.475 |
5 |
0 |
0 |
0.127 |
22 |
|
[ADP]G:601 |
27 |
1 |
571 |
f |
G |
x,y,z |
1_555 |
47 |
23 |
12627 |
356.9 |
-5.4 |
0.469 |
5 |
0 |
0 |
0.127 |
23 |
|
[ADP]J:601 |
27 |
1 |
569 |
f |
J |
x,y,z |
1_555 |
49 |
24 |
12683 |
353.9 |
-6.2 |
0.412 |
0 |
0 |
0 |
0.127 |
Average: |
356.2 |
-5.6 |
0.452 |
3 |
0 |
0 |
0.127 |
14 |
24 |
|
[ADP]O:601 |
27 |
1 |
569 |
f |
O |
x,y,z |
1_555 |
48 |
23 |
7820 |
355.3 |
-5.2 |
0.515 |
5 |
0 |
0 |
0.181 |
25 |
|
[ADP]K:601 |
27 |
1 |
571 |
f |
K |
x,y,z |
1_555 |
47 |
23 |
7783 |
343.7 |
-6.1 |
0.368 |
4 |
0 |
0 |
0.181 |
Average: |
349.5 |
-5.6 |
0.442 |
5 |
0 |
0 |
0.181 |
15 |
26 |
|
M |
30 |
8 |
12702 |
◊ |
D |
x,y-1,z |
1_545 |
37 |
13 |
12716 |
351.2 |
1.3 |
0.537 |
5 |
2 |
0 |
0.000 |
16 |
27 |
|
[ADP]P:601 |
27 |
1 |
563 |
f |
P |
x,y,z |
1_555 |
48 |
24 |
7899 |
350.8 |
-4.8 |
0.528 |
6 |
0 |
0 |
0.176 |
17 |
28 |
|
[ADP]B:601 |
27 |
1 |
572 |
f |
B |
x,y,z |
1_555 |
47 |
23 |
12680 |
350.4 |
-4.0 |
0.480 |
6 |
0 |
0 |
0.202 |
29 |
|
[ADP]M:601 |
27 |
1 |
567 |
f |
M |
x,y,z |
1_555 |
48 |
23 |
12702 |
345.5 |
-3.9 |
0.500 |
4 |
0 |
0 |
0.202 |
30 |
|
[ADP]H:601 |
27 |
1 |
569 |
f |
H |
x,y,z |
1_555 |
48 |
24 |
12777 |
335.1 |
-3.1 |
0.499 |
5 |
0 |
0 |
0.202 |
31 |
|
[ADP]N:601 |
27 |
1 |
569 |
f |
N |
x,y,z |
1_555 |
46 |
22 |
12687 |
333.9 |
-3.2 |
0.477 |
7 |
0 |
0 |
0.202 |
Average: |
341.2 |
-3.5 |
0.489 |
6 |
0 |
0 |
0.202 |
18 |
32 |
|
[ADP]L:601 |
26 |
1 |
570 |
f |
L |
x,y,z |
1_555 |
46 |
23 |
7751 |
337.7 |
-3.6 |
0.514 |
6 |
0 |
0 |
0.144 |
19 |
33 |
|
M |
33 |
11 |
12702 |
◊ |
E |
x,y,z |
1_555 |
40 |
13 |
12621 |
336.7 |
-0.6 |
0.605 |
3 |
3 |
0 |
0.000 |
20 |
34 |
|
I |
32 |
9 |
12641 |
◊ |
G |
x,y-1,z-1 |
1_544 |
32 |
10 |
12627 |
331.6 |
0.9 |
0.589 |
7 |
4 |
0 |
0.000 |
21 |
35 |
|
[ADP]I:601 |
26 |
1 |
568 |
f |
I |
x,y,z |
1_555 |
40 |
19 |
12641 |
301.5 |
-1.1 |
0.531 |
4 |
0 |
0 |
0.100 |
22 |
36 |
|
M |
32 |
9 |
12702 |
◊ |
C |
x-1,y-1,z |
1_445 |
29 |
7 |
12738 |
286.8 |
2.8 |
0.840 |
3 |
8 |
0 |
0.000 |
23 |
37 |
|
A |
27 |
8 |
12727 |
◊ |
D |
x,y-1,z |
1_545 |
32 |
9 |
12716 |
281.9 |
0.4 |
0.678 |
1 |
5 |
0 |
0.000 |
24 |
38 |
|
L |
29 |
7 |
7751 |
◊ |
B |
x-1,y,z |
1_455 |
33 |
7 |
12680 |
271.1 |
-0.9 |
0.583 |
2 |
1 |
0 |
0.000 |
25 |
39 |
|
G |
35 |
8 |
12627 |
◊ |
F |
x-1,y,z |
1_455 |
32 |
11 |
12652 |
267.6 |
1.2 |
0.740 |
1 |
0 |
0 |
0.000 |
26 |
40 |
|
J |
33 |
9 |
12683 |
◊ |
E |
x,y,z-1 |
1_554 |
28 |
8 |
12621 |
244.6 |
0.3 |
0.670 |
2 |
5 |
0 |
0.000 |
27 |
41 |
|
N |
25 |
7 |
12687 |
◊ |
B |
x-1,y,z |
1_455 |
27 |
8 |
12680 |
237.8 |
0.6 |
0.694 |
0 |
2 |
0 |
0.000 |
28 |
42 |
|
H |
28 |
7 |
12777 |
◊ |
A |
x-1,y,z |
1_455 |
22 |
6 |
12727 |
217.6 |
2.5 |
0.841 |
1 |
2 |
0 |
0.000 |
29 |
43 |
|
I |
22 |
8 |
12641 |
◊ |
E |
x-1,y,z-1 |
1_454 |
21 |
8 |
12621 |
207.9 |
1.0 |
0.678 |
1 |
0 |
0 |
0.000 |
30 |
44 |
|
G |
19 |
6 |
12627 |
◊ |
B |
x-1,y,z |
1_455 |
23 |
8 |
12680 |
204.1 |
1.5 |
0.770 |
3 |
0 |
0 |
0.000 |
31 |
45 |
|
F |
24 |
7 |
12652 |
◊ |
C |
x,y-1,z |
1_545 |
27 |
8 |
12738 |
197.7 |
1.5 |
0.760 |
2 |
1 |
0 |
0.000 |
32 |
46 |
|
J |
21 |
8 |
12683 |
◊ |
N |
x,y,z-1 |
1_554 |
19 |
6 |
12687 |
195.9 |
-1.2 |
0.477 |
0 |
3 |
0 |
0.000 |
33 |
47 |
|
J |
20 |
5 |
12683 |
◊ |
E |
x-1,y,z-1 |
1_454 |
20 |
6 |
12621 |
184.1 |
0.9 |
0.730 |
0 |
1 |
0 |
0.000 |
34 |
48 |
|
E |
20 |
6 |
12621 |
◊ |
D |
x,y-1,z |
1_545 |
17 |
4 |
12716 |
167.9 |
1.4 |
0.725 |
2 |
0 |
0 |
0.000 |
35 |
49 |
|
K |
19 |
6 |
7783 |
◊ |
E |
x-1,y,z-1 |
1_454 |
16 |
4 |
12621 |
139.5 |
0.4 |
0.679 |
0 |
1 |
0 |
0.000 |
36 |
50 |
|
O |
14 |
5 |
7820 |
◊ |
A |
x-1,y-1,z |
1_445 |
9 |
3 |
12727 |
113.9 |
1.0 |
0.769 |
2 |
3 |
0 |
0.000 |
37 |
51 |
|
F |
11 |
4 |
12652 |
◊ |
D |
x,y-1,z |
1_545 |
14 |
4 |
12716 |
110.7 |
0.2 |
0.644 |
2 |
0 |
0 |
0.000 |
38 |
52 |
|
D |
12 |
4 |
12716 |
◊ |
A |
x,y,z |
1_555 |
14 |
3 |
12727 |
107.1 |
0.6 |
0.692 |
1 |
0 |
0 |
0.000 |
39 |
53 |
|
K |
12 |
5 |
7783 |
◊ |
F |
x-1,y,z-1 |
1_454 |
18 |
8 |
12652 |
102.8 |
1.0 |
0.676 |
0 |
0 |
0 |
0.000 |
40 |
54 |
|
I |
15 |
5 |
12641 |
◊ |
H |
x,y,z-1 |
1_554 |
11 |
5 |
12777 |
97.4 |
0.8 |
0.717 |
0 |
0 |
0 |
0.000 |
41 |
55 |
|
E |
9 |
4 |
12621 |
◊ |
C |
x,y-1,z |
1_545 |
8 |
3 |
12738 |
73.9 |
0.6 |
0.698 |
0 |
0 |
0 |
0.000 |
42 |
56 |
|
I |
10 |
4 |
12641 |
◊ |
B |
x-1,y-1,z-1 |
1_444 |
13 |
5 |
12680 |
69.4 |
-0.0 |
0.615 |
1 |
0 |
0 |
0.000 |
43 |
57 |
|
N |
7 |
3 |
12687 |
◊ |
B |
x-1,y-1,z |
1_445 |
6 |
2 |
12680 |
47.8 |
0.1 |
0.602 |
0 |
0 |
0 |
0.000 |
44 |
58 |
|
[ADP]J:601 |
5 |
1 |
569 |
◊ |
I |
x,y,z |
1_555 |
5 |
2 |
12641 |
40.4 |
-2.2 |
0.334 |
0 |
0 |
0 |
0.039 |
45 |
59 |
|
P |
4 |
1 |
7899 |
◊ |
N |
x,y,z |
1_555 |
6 |
2 |
12687 |
39.2 |
0.7 |
0.786 |
0 |
0 |
0 |
0.000 |
46 |
60 |
|
N |
2 |
1 |
12687 |
◊ |
D |
x-1,y-1,z |
1_445 |
4 |
2 |
12716 |
31.3 |
0.6 |
0.763 |
1 |
1 |
0 |
0.000 |
47 |
61 |
|
[ADP]K:601 |
3 |
1 |
571 |
◊ |
L |
x,y,z |
1_555 |
8 |
2 |
7751 |
30.5 |
-1.6 |
0.421 |
0 |
0 |
0 |
0.037 |
48 |
62 |
|
O |
6 |
2 |
7820 |
◊ |
M |
x,y,z |
1_555 |
4 |
1 |
12702 |
30.1 |
0.5 |
0.750 |
0 |
0 |
0 |
0.000 |
49 |
63 |
|
F |
3 |
3 |
12652 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
12680 |
27.2 |
0.4 |
0.755 |
0 |
0 |
0 |
0.000 |
50 |
64 |
|
M |
2 |
2 |
12702 |
◊ |
B |
x-1,y,z |
1_455 |
5 |
3 |
12680 |
23.5 |
0.3 |
0.697 |
0 |
0 |
0 |
0.000 |
51 |
65 |
|
N |
3 |
1 |
12687 |
◊ |
C |
x,y-1,z |
1_545 |
2 |
1 |
12738 |
21.2 |
-0.1 |
0.414 |
0 |
0 |
0 |
0.000 |
52 |
66 |
|
[ADP]F:601 |
3 |
1 |
567 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
12621 |
18.8 |
-1.0 |
0.464 |
0 |
0 |
0 |
0.016 |
67 |
|
[ADP]C:601 |
3 |
1 |
570 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
12716 |
10.6 |
-0.7 |
0.434 |
0 |
0 |
0 |
0.016 |
68 |
|
[ADP]G:601 |
3 |
1 |
571 |
◊ |
H |
x,y,z |
1_555 |
1 |
1 |
12777 |
8.5 |
-0.6 |
0.371 |
0 |
0 |
0 |
0.016 |
Average: |
12.6 |
-0.7 |
0.423 |
0 |
0 |
0 |
0.016 |
53 |
69 |
|
[ADP]P:601 |
3 |
1 |
563 |
◊ |
O |
x,y,z |
1_555 |
3 |
2 |
7820 |
16.7 |
-1.0 |
0.448 |
0 |
0 |
0 |
0.024 |
54 |
70 |
|
H |
4 |
1 |
12777 |
◊ |
D |
x,y,z |
1_555 |
4 |
1 |
12716 |
15.1 |
0.1 |
0.651 |
0 |
0 |
0 |
0.000 |
55 |
71 |
|
[ADP]N:601 |
4 |
1 |
569 |
◊ |
[ADP]M:601 |
x,y,z |
1_555 |
4 |
1 |
567 |
14.1 |
-0.7 |
0.582 |
0 |
0 |
0 |
0.012 |
56 |
72 |
|
[ADP]E:601 |
3 |
1 |
567 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
12652 |
13.2 |
-0.4 |
0.653 |
0 |
0 |
0 |
0.006 |
73 |
|
[ADP]M:601 |
1 |
1 |
567 |
◊ |
N |
x,y,z |
1_555 |
1 |
1 |
12687 |
9.3 |
-0.4 |
0.491 |
0 |
0 |
0 |
0.006 |
Average: |
11.2 |
-0.4 |
0.572 |
0 |
0 |
0 |
0.006 |
57 |
74 |
|
[ADP]B:601 |
3 |
1 |
572 |
◊ |
A |
x,y,z |
1_555 |
4 |
3 |
12727 |
11.4 |
-0.6 |
0.539 |
0 |
0 |
0 |
0.011 |
75 |
|
[ADP]N:601 |
3 |
1 |
569 |
◊ |
M |
x,y,z |
1_555 |
2 |
2 |
12702 |
7.1 |
-0.3 |
0.608 |
0 |
0 |
0 |
0.011 |
76 |
|
[ADP]H:601 |
1 |
1 |
569 |
◊ |
G |
x,y,z |
1_555 |
1 |
1 |
12627 |
0.3 |
-0.0 |
0.578 |
0 |
0 |
0 |
0.011 |
Average: |
6.2 |
-0.3 |
0.575 |
0 |
0 |
0 |
0.011 |
58 |
77 |
|
[ADP]L:601 |
2 |
1 |
570 |
◊ |
K |
x,y,z |
1_555 |
2 |
1 |
7783 |
11.3 |
-0.5 |
0.555 |
0 |
0 |
0 |
0.011 |
59 |
78 |
|
[ADP]F:601 |
3 |
1 |
567 |
◊ |
[ADP]E:601 |
x,y,z |
1_555 |
4 |
1 |
567 |
11.3 |
-0.7 |
0.555 |
0 |
0 |
0 |
0.012 |
60 |
79 |
|
J |
2 |
1 |
12683 |
◊ |
G |
x,y,z-1 |
1_554 |
1 |
1 |
12627 |
8.4 |
0.2 |
0.768 |
0 |
0 |
0 |
0.000 |
61 |
80 |
|
[ADP]B:601 |
2 |
1 |
572 |
◊ |
[ADP]A:601 |
x,y,z |
1_555 |
2 |
1 |
563 |
7.8 |
-0.5 |
0.479 |
0 |
0 |
0 |
0.009 |
62 |
81 |
|
[ADP]A:601 |
2 |
1 |
563 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
12680 |
6.9 |
-0.3 |
0.609 |
0 |
0 |
0 |
0.007 |
82 |
|
[ADP]D:601 |
3 |
1 |
569 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
12738 |
6.7 |
-0.4 |
0.408 |
0 |
0 |
0 |
0.007 |
Average: |
6.8 |
-0.4 |
0.508 |
0 |
0 |
0 |
0.007 |
63 |
83 |
|
K |
2 |
1 |
7783 |
◊ |
P |
x-1,y,z |
1_455 |
1 |
1 |
7899 |
5.4 |
0.2 |
0.781 |
0 |
0 |
0 |
0.000 |
64 |
84 |
|
[ADP]I:601 |
1 |
1 |
568 |
◊ |
J |
x,y,z |
1_555 |
1 |
1 |
12683 |
5.3 |
-0.2 |
0.513 |
0 |
0 |
0 |
0.004 |
65 |
85 |
|
[ADP]O:601 |
2 |
1 |
569 |
◊ |
P |
x,y,z |
1_555 |
1 |
1 |
7899 |
3.7 |
-0.3 |
0.458 |
0 |
0 |
0 |
0.006 |
66 |
86 |
|
[ADP]H:601 |
3 |
1 |
569 |
◊ |
[ADP]G:601 |
x,y,z |
1_555 |
1 |
1 |
571 |
3.2 |
-0.1 |
0.480 |
0 |
0 |
0 |
0.002 |
67 |
87 |
|
I |
1 |
1 |
12641 |
◊ |
C |
x-1,y-1,z-1 |
1_444 |
1 |
1 |
12738 |
2.7 |
0.1 |
0.791 |
0 |
0 |
0 |
0.000 |
68 |
88 |
|
[ADP]F:601 |
1 |
1 |
567 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
12727 |
1.7 |
0.1 |
0.593 |
0 |
0 |
0 |
0.000 |
69 |
89 |
|
N |
1 |
1 |
12687 |
◊ |
D |
x,y-1,z |
1_545 |
1 |
1 |
12716 |
0.1 |
0.0 |
0.684 |
0 |
0 |
0 |
0.000 |
|