## |
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 |
106 |
24 |
3593 |
◊ |
E |
x,y,z |
1_555 |
117 |
26 |
17644 |
1181.6 |
-17.8 |
0.029 |
9 |
2 |
0 |
0.601 |
2 |
|
L |
106 |
26 |
3474 |
◊ |
K |
x,y,z |
1_555 |
117 |
26 |
17645 |
1114.9 |
-18.7 |
0.021 |
5 |
1 |
0 |
0.601 |
Average: |
1148.2 |
-18.3 |
0.025 |
7 |
2 |
0 |
0.601 |
2 |
3 |
|
D |
108 |
24 |
3662 |
◊ |
C |
x,y,z |
1_555 |
128 |
28 |
17925 |
1119.4 |
-23.1 |
0.005 |
4 |
1 |
0 |
0.628 |
4 |
|
J |
105 |
23 |
3630 |
◊ |
I |
x,y,z |
1_555 |
129 |
30 |
18050 |
1115.8 |
-23.0 |
0.004 |
5 |
1 |
0 |
0.628 |
Average: |
1117.6 |
-23.1 |
0.005 |
5 |
1 |
0 |
0.628 |
3 |
5 |
|
K |
123 |
35 |
17645 |
◊ |
I |
x,y,z |
1_555 |
126 |
34 |
18050 |
1067.7 |
1.5 |
0.548 |
18 |
0 |
0 |
0.071 |
6 |
|
E |
120 |
36 |
17644 |
◊ |
C |
x,y,z |
1_555 |
122 |
35 |
17925 |
1055.6 |
1.7 |
0.560 |
16 |
0 |
0 |
0.071 |
Average: |
1061.6 |
1.6 |
0.554 |
17 |
0 |
0 |
0.071 |
4 |
7 |
|
Y |
70 |
15 |
3552 |
◊ |
A |
x,y,z |
1_555 |
77 |
15 |
3471 |
713.8 |
-10.3 |
0.561 |
49 |
0 |
0 |
1.000 |
8 |
|
Z |
68 |
15 |
3569 |
◊ |
G |
x,y,z |
1_555 |
72 |
15 |
3469 |
712.3 |
-11.6 |
0.508 |
50 |
0 |
0 |
1.000 |
Average: |
713.1 |
-11.0 |
0.534 |
50 |
0 |
0 |
1.000 |
5 |
9 |
|
I |
41 |
11 |
18050 |
◊ |
E |
x,y,z |
1_555 |
55 |
18 |
17644 |
467.9 |
3.1 |
0.732 |
11 |
2 |
0 |
0.000 |
10 |
|
C |
37 |
11 |
17925 |
◊ |
K |
x,y,z-1 |
1_554 |
53 |
17 |
17645 |
435.6 |
2.3 |
0.703 |
9 |
3 |
0 |
0.000 |
Average: |
451.7 |
2.7 |
0.718 |
10 |
3 |
0 |
0.000 |
6 |
11 |
|
K |
47 |
14 |
17645 |
◊ |
E |
x-1,y,z |
1_455 |
45 |
14 |
17644 |
466.3 |
1.0 |
0.578 |
6 |
4 |
0 |
0.000 |
12 |
|
K |
45 |
14 |
17645 |
◊ |
E |
x-1,y,z+1 |
1_456 |
51 |
15 |
17644 |
428.9 |
0.4 |
0.525 |
4 |
4 |
0 |
0.000 |
Average: |
447.6 |
0.7 |
0.551 |
5 |
4 |
0 |
0.000 |
7 |
13 |
|
[ANP]C:901 |
28 |
1 |
647 |
f |
C |
x,y,z |
1_555 |
48 |
19 |
17925 |
348.5 |
0.6 |
0.638 |
15 |
0 |
0 |
0.236 |
14 |
|
[ANP]I:901 |
28 |
1 |
645 |
f |
I |
x,y,z |
1_555 |
53 |
20 |
18050 |
347.6 |
0.9 |
0.630 |
15 |
0 |
0 |
0.236 |
15 |
|
[ANP]E:901 |
28 |
1 |
647 |
f |
E |
x,y,z |
1_555 |
50 |
20 |
17644 |
346.3 |
0.6 |
0.601 |
14 |
0 |
0 |
0.236 |
16 |
|
[ANP]K:901 |
28 |
1 |
642 |
f |
K |
x,y,z |
1_555 |
51 |
20 |
17645 |
338.3 |
-1.7 |
0.422 |
17 |
0 |
0 |
0.236 |
Average: |
345.2 |
0.1 |
0.573 |
15 |
0 |
0 |
0.236 |
8 |
17 |
|
K |
25 |
10 |
17645 |
x |
K |
x-1,y,z |
1_455 |
44 |
15 |
17645 |
331.3 |
0.2 |
0.519 |
3 |
3 |
0 |
0.000 |
18 |
|
E |
43 |
13 |
17644 |
x |
E |
x-1,y,z |
1_455 |
22 |
9 |
17644 |
325.1 |
1.3 |
0.589 |
4 |
2 |
0 |
0.000 |
Average: |
328.2 |
0.8 |
0.554 |
4 |
3 |
0 |
0.000 |
9 |
19 |
|
C |
29 |
9 |
17925 |
x |
C |
x-1,y,z |
1_455 |
27 |
14 |
17925 |
246.3 |
2.7 |
0.779 |
2 |
2 |
0 |
0.000 |
20 |
|
I |
30 |
13 |
18050 |
x |
I |
x-1,y,z |
1_455 |
30 |
10 |
18050 |
231.9 |
1.7 |
0.672 |
1 |
2 |
0 |
0.000 |
Average: |
239.1 |
2.2 |
0.726 |
2 |
2 |
0 |
0.000 |
10 |
21 |
|
G |
27 |
5 |
3469 |
◊ |
I |
x,y,z |
1_555 |
27 |
9 |
18050 |
237.2 |
-1.7 |
0.576 |
6 |
0 |
0 |
0.000 |
22 |
|
A |
26 |
5 |
3471 |
◊ |
C |
x,y,z |
1_555 |
27 |
9 |
17925 |
235.1 |
-3.1 |
0.457 |
4 |
0 |
0 |
0.000 |
Average: |
236.2 |
-2.4 |
0.516 |
5 |
0 |
0 |
0.000 |
11 |
23 |
|
[ANP]C:901 |
24 |
1 |
647 |
◊ |
E |
x,y,z |
1_555 |
27 |
11 |
17644 |
178.6 |
0.6 |
0.625 |
6 |
0 |
0 |
0.039 |
24 |
|
[ANP]I:901 |
24 |
1 |
645 |
◊ |
K |
x,y,z |
1_555 |
25 |
10 |
17645 |
178.4 |
0.3 |
0.603 |
6 |
0 |
0 |
0.039 |
25 |
|
[ANP]K:901 |
24 |
1 |
642 |
◊ |
I |
x,y,z |
1_555 |
25 |
11 |
18050 |
177.3 |
1.1 |
0.653 |
5 |
0 |
0 |
0.039 |
26 |
|
[ANP]E:901 |
24 |
1 |
647 |
◊ |
C |
x,y,z |
1_555 |
25 |
11 |
17925 |
174.7 |
1.0 |
0.661 |
5 |
0 |
0 |
0.039 |
Average: |
177.2 |
0.7 |
0.636 |
6 |
0 |
0 |
0.039 |
12 |
27 |
|
C |
19 |
5 |
17925 |
◊ |
E |
x-1,y,z |
1_455 |
14 |
4 |
17644 |
128.0 |
1.1 |
0.663 |
0 |
0 |
0 |
0.000 |
28 |
|
K |
12 |
3 |
17645 |
◊ |
I |
x-1,y,z |
1_455 |
15 |
3 |
18050 |
118.1 |
0.2 |
0.578 |
2 |
3 |
0 |
0.000 |
Average: |
123.1 |
0.6 |
0.621 |
1 |
2 |
0 |
0.000 |
13 |
29 |
|
K |
15 |
3 |
17645 |
◊ |
C |
x-1,y,z |
1_455 |
15 |
4 |
17925 |
122.7 |
-1.4 |
0.234 |
0 |
0 |
0 |
0.000 |
30 |
|
I |
15 |
4 |
18050 |
◊ |
E |
x-1,y,z+1 |
1_456 |
12 |
2 |
17644 |
113.3 |
-0.6 |
0.325 |
0 |
0 |
0 |
0.000 |
Average: |
118.0 |
-1.0 |
0.280 |
0 |
0 |
0 |
0.000 |
14 |
31 |
|
C |
8 |
3 |
17925 |
◊ |
A |
x-1,y,z |
1_455 |
14 |
4 |
3471 |
114.4 |
-0.9 |
0.390 |
2 |
0 |
0 |
0.000 |
32 |
|
G |
15 |
5 |
3469 |
◊ |
I |
x-1,y,z |
1_455 |
8 |
4 |
18050 |
100.5 |
-1.0 |
0.443 |
3 |
0 |
0 |
0.000 |
Average: |
107.5 |
-1.0 |
0.416 |
3 |
0 |
0 |
0.000 |
15 |
33 |
|
G |
14 |
1 |
3469 |
◊ |
Z |
x-1,y,z |
1_455 |
12 |
1 |
3569 |
98.3 |
1.1 |
0.722 |
1 |
0 |
0 |
0.000 |
34 |
|
Y |
12 |
1 |
3552 |
◊ |
A |
x-1,y,z |
1_455 |
15 |
1 |
3471 |
96.0 |
1.4 |
0.738 |
0 |
0 |
0 |
0.000 |
Average: |
97.1 |
1.3 |
0.730 |
1 |
0 |
0 |
0.000 |
16 |
35 |
|
F |
9 |
5 |
3593 |
◊ |
D |
x,y-1,z |
1_545 |
10 |
3 |
3662 |
96.4 |
1.4 |
0.805 |
1 |
2 |
0 |
0.000 |
36 |
|
J |
9 |
2 |
3630 |
◊ |
L |
x,y-1,z |
1_545 |
11 |
5 |
3474 |
92.0 |
1.3 |
0.797 |
0 |
1 |
0 |
0.000 |
Average: |
94.2 |
1.4 |
0.801 |
1 |
2 |
0 |
0.000 |
17 |
37 |
|
Z |
11 |
1 |
3569 |
◊ |
G |
x-1,y,z |
1_455 |
13 |
1 |
3469 |
78.0 |
0.2 |
0.646 |
1 |
0 |
0 |
0.000 |
38 |
|
A |
12 |
1 |
3471 |
◊ |
Y |
x-1,y,z |
1_455 |
11 |
1 |
3552 |
75.9 |
0.0 |
0.631 |
0 |
0 |
0 |
0.000 |
Average: |
76.9 |
0.1 |
0.638 |
1 |
0 |
0 |
0.000 |
18 |
39 |
|
K |
10 |
2 |
17645 |
◊ |
C |
x-1,y-1,z+1 |
1_446 |
10 |
2 |
17925 |
77.8 |
-0.7 |
0.402 |
0 |
0 |
0 |
0.000 |
40 |
|
I |
9 |
2 |
18050 |
◊ |
E |
x-1,y-1,z |
1_445 |
12 |
5 |
17644 |
73.7 |
-0.6 |
0.430 |
0 |
0 |
0 |
0.000 |
Average: |
75.8 |
-0.7 |
0.416 |
0 |
0 |
0 |
0.000 |
19 |
41 |
|
I |
7 |
3 |
18050 |
◊ |
C |
x,y-1,z |
1_545 |
15 |
6 |
17925 |
74.5 |
1.3 |
0.744 |
0 |
0 |
0 |
0.000 |
42 |
|
I |
6 |
2 |
18050 |
◊ |
C |
x,y-1,z+1 |
1_546 |
4 |
2 |
17925 |
28.0 |
-0.0 |
0.553 |
0 |
0 |
0 |
0.000 |
Average: |
51.2 |
0.6 |
0.649 |
0 |
0 |
0 |
0.000 |
20 |
43 |
|
I |
13 |
4 |
18050 |
◊ |
L |
x,y-1,z |
1_545 |
5 |
1 |
3474 |
72.9 |
0.3 |
0.633 |
1 |
1 |
0 |
0.000 |
44 |
|
F |
7 |
2 |
3593 |
◊ |
C |
x,y-1,z |
1_545 |
10 |
4 |
17925 |
71.3 |
-0.3 |
0.554 |
0 |
1 |
0 |
0.000 |
Average: |
72.1 |
0.0 |
0.593 |
1 |
1 |
0 |
0.000 |
21 |
45 |
|
G |
12 |
2 |
3469 |
x |
G |
x-1,y,z |
1_455 |
12 |
1 |
3469 |
70.4 |
1.8 |
0.764 |
0 |
0 |
0 |
0.000 |
46 |
|
A |
10 |
1 |
3471 |
x |
A |
x-1,y,z |
1_455 |
9 |
2 |
3471 |
64.7 |
2.0 |
0.767 |
0 |
0 |
0 |
0.000 |
Average: |
67.5 |
1.9 |
0.766 |
0 |
0 |
0 |
0.000 |
22 |
47 |
|
[MG]I:902 |
1 |
1 |
98 |
f |
I |
x,y,z |
1_555 |
13 |
6 |
18050 |
41.6 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.133 |
48 |
|
[MG]E:902 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
10 |
5 |
17644 |
37.5 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.133 |
49 |
|
[MG]C:902 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
4 |
17925 |
36.8 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.133 |
50 |
|
[MG]K:902 |
1 |
1 |
98 |
f |
K |
x,y,z |
1_555 |
10 |
5 |
17645 |
34.9 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.133 |
Average: |
37.7 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.133 |
23 |
51 |
|
Z |
6 |
2 |
3569 |
◊ |
I |
x,y,z |
1_555 |
3 |
1 |
18050 |
35.5 |
-1.2 |
0.457 |
1 |
0 |
0 |
0.000 |
52 |
|
Y |
4 |
2 |
3552 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
17925 |
31.7 |
-0.7 |
0.434 |
1 |
0 |
0 |
0.000 |
Average: |
33.6 |
-1.0 |
0.445 |
1 |
0 |
0 |
0.000 |
24 |
53 |
|
D |
4 |
3 |
3662 |
◊ |
E |
x-1,y+1,z |
1_465 |
5 |
2 |
17644 |
32.5 |
0.1 |
0.601 |
0 |
0 |
0 |
0.000 |
54 |
|
K |
1 |
1 |
17645 |
◊ |
J |
x-1,y+1,z |
1_465 |
1 |
1 |
3630 |
7.9 |
0.0 |
0.436 |
0 |
0 |
0 |
0.000 |
Average: |
20.2 |
0.0 |
0.518 |
0 |
0 |
0 |
0.000 |
25 |
55 |
|
[MG]C:902 |
1 |
1 |
98 |
f |
[ANP]C:901 |
x,y,z |
1_555 |
4 |
1 |
647 |
30.4 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.113 |
56 |
|
[MG]K:902 |
1 |
1 |
98 |
f |
[ANP]K:901 |
x,y,z |
1_555 |
4 |
1 |
642 |
30.2 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.113 |
57 |
|
[MG]I:902 |
1 |
1 |
98 |
f |
[ANP]I:901 |
x,y,z |
1_555 |
4 |
1 |
645 |
30.2 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.113 |
58 |
|
[MG]E:902 |
1 |
1 |
98 |
f |
[ANP]E:901 |
x,y,z |
1_555 |
4 |
1 |
647 |
29.5 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.113 |
Average: |
30.1 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.113 |
26 |
59 |
|
Y |
3 |
2 |
3552 |
x |
Y |
x-1,y,z |
1_455 |
4 |
1 |
3552 |
27.2 |
1.0 |
0.675 |
0 |
0 |
0 |
0.000 |
60 |
|
Z |
1 |
1 |
3569 |
x |
Z |
x-1,y,z |
1_455 |
3 |
2 |
3569 |
20.8 |
0.8 |
0.702 |
0 |
0 |
0 |
0.000 |
Average: |
24.0 |
0.9 |
0.688 |
0 |
0 |
0 |
0.000 |
27 |
61 |
|
G |
6 |
2 |
3469 |
◊ |
F |
x-1,y,z |
1_455 |
2 |
1 |
3593 |
23.6 |
-0.2 |
0.622 |
0 |
0 |
0 |
0.000 |
28 |
62 |
|
J |
2 |
1 |
3630 |
◊ |
C |
x,y-1,z |
1_545 |
4 |
2 |
17925 |
18.8 |
0.5 |
0.759 |
0 |
0 |
0 |
0.000 |
63 |
|
I |
6 |
3 |
18050 |
◊ |
D |
x,y-1,z+1 |
1_546 |
2 |
1 |
3662 |
16.5 |
0.3 |
0.711 |
0 |
0 |
0 |
0.000 |
Average: |
17.6 |
0.4 |
0.735 |
0 |
0 |
0 |
0.000 |
29 |
64 |
|
K |
4 |
3 |
17645 |
◊ |
E |
x,y,z |
1_555 |
4 |
2 |
17644 |
18.7 |
0.6 |
0.770 |
0 |
0 |
0 |
0.000 |
65 |
|
E |
1 |
1 |
17644 |
◊ |
K |
x,y,z-1 |
1_554 |
2 |
1 |
17645 |
5.0 |
0.1 |
0.742 |
0 |
0 |
0 |
0.000 |
Average: |
11.8 |
0.4 |
0.756 |
0 |
0 |
0 |
0.000 |
30 |
66 |
|
[MG]K:902 |
1 |
1 |
98 |
◊ |
I |
x,y,z |
1_555 |
4 |
2 |
18050 |
13.6 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.027 |
67 |
|
[MG]E:902 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
17925 |
11.3 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.027 |
68 |
|
[MG]C:902 |
1 |
1 |
98 |
◊ |
E |
x,y,z |
1_555 |
4 |
2 |
17644 |
11.1 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.027 |
69 |
|
[MG]I:902 |
1 |
1 |
98 |
◊ |
K |
x,y,z |
1_555 |
3 |
2 |
17645 |
8.0 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.027 |
Average: |
11.0 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.027 |
31 |
70 |
|
Z |
1 |
1 |
3569 |
◊ |
I |
x-1,y,z |
1_455 |
2 |
1 |
18050 |
3.8 |
-0.0 |
0.495 |
0 |
0 |
0 |
0.000 |
32 |
71 |
|
K |
1 |
1 |
17645 |
◊ |
F |
x-1,y,z+1 |
1_456 |
3 |
1 |
3593 |
3.4 |
-0.0 |
0.490 |
0 |
0 |
0 |
0.000 |
72 |
|
L |
1 |
1 |
3474 |
◊ |
E |
x-1,y,z |
1_455 |
1 |
1 |
17644 |
2.4 |
-0.0 |
0.550 |
0 |
0 |
0 |
0.000 |
Average: |
2.9 |
-0.0 |
0.520 |
0 |
0 |
0 |
0.000 |
33 |
73 |
|
Z |
2 |
1 |
3569 |
◊ |
C |
x,y-1,z |
1_545 |
2 |
1 |
17925 |
3.2 |
-0.2 |
0.426 |
0 |
0 |
0 |
0.000 |
|