## |
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 |
318 |
76 |
10833 |
◊ |
E |
x,y,z |
1_555 |
315 |
77 |
10886 |
3226.4 |
-31.9 |
0.192 |
50 |
3 |
0 |
0.914 |
2 |
|
B |
320 |
78 |
11047 |
◊ |
A |
x,y,z |
1_555 |
321 |
78 |
11167 |
3212.9 |
-35.9 |
0.092 |
55 |
0 |
0 |
0.914 |
3 |
|
D |
320 |
76 |
11161 |
◊ |
C |
x,y,z |
1_555 |
324 |
77 |
10733 |
3196.8 |
-35.8 |
0.138 |
48 |
0 |
0 |
0.914 |
4 |
|
H |
324 |
77 |
10897 |
◊ |
G |
x,y,z |
1_555 |
331 |
80 |
11104 |
3193.1 |
-36.8 |
0.108 |
55 |
0 |
0 |
0.914 |
Average: |
3207.3 |
-35.1 |
0.133 |
52 |
1 |
0 |
0.914 |
2 |
5 |
|
D |
46 |
15 |
11161 |
◊ |
A |
x,y,z |
1_555 |
39 |
13 |
11167 |
429.0 |
-9.1 |
0.050 |
2 |
0 |
0 |
0.440 |
6 |
|
G |
38 |
15 |
11104 |
◊ |
B |
x,y,z |
1_555 |
38 |
15 |
11047 |
420.2 |
-9.8 |
0.024 |
1 |
0 |
0 |
0.440 |
7 |
|
F |
35 |
14 |
10833 |
◊ |
C |
x,y,z |
1_555 |
41 |
14 |
10733 |
388.1 |
-9.6 |
0.024 |
1 |
0 |
0 |
0.440 |
8 |
|
H |
34 |
13 |
10897 |
◊ |
E |
x,y,z |
1_555 |
38 |
13 |
10886 |
360.7 |
-9.2 |
0.019 |
2 |
0 |
0 |
0.440 |
Average: |
399.5 |
-9.4 |
0.029 |
2 |
0 |
0 |
0.440 |
3 |
9 |
|
G |
53 |
17 |
11104 |
◊ |
A |
x,y,z |
1_555 |
40 |
11 |
11167 |
426.8 |
-0.9 |
0.662 |
7 |
0 |
0 |
0.079 |
10 |
|
D |
51 |
17 |
11161 |
◊ |
B |
x,y,z |
1_555 |
39 |
10 |
11047 |
419.3 |
0.1 |
0.696 |
5 |
0 |
0 |
0.079 |
11 |
|
E |
42 |
11 |
10886 |
◊ |
C |
x,y,z |
1_555 |
47 |
15 |
10733 |
418.3 |
-2.0 |
0.589 |
4 |
0 |
0 |
0.079 |
12 |
|
C |
38 |
9 |
10733 |
◊ |
A |
x,y,z |
1_555 |
42 |
15 |
11167 |
389.0 |
-4.0 |
0.288 |
3 |
0 |
0 |
0.079 |
13 |
|
H |
36 |
9 |
10897 |
◊ |
B |
x,y,z |
1_555 |
47 |
15 |
11047 |
366.6 |
-1.8 |
0.546 |
4 |
0 |
0 |
0.079 |
14 |
|
H |
44 |
16 |
10897 |
◊ |
F |
x,y,z |
1_555 |
35 |
9 |
10833 |
357.3 |
-2.3 |
0.494 |
4 |
0 |
0 |
0.079 |
15 |
|
G |
35 |
9 |
11104 |
◊ |
E |
x,y,z |
1_555 |
42 |
16 |
10886 |
354.4 |
-0.5 |
0.677 |
6 |
0 |
0 |
0.079 |
16 |
|
F |
48 |
18 |
10833 |
◊ |
D |
x,y,z |
1_555 |
37 |
8 |
11161 |
346.3 |
-3.0 |
0.439 |
4 |
0 |
0 |
0.079 |
Average: |
384.8 |
-1.8 |
0.549 |
5 |
0 |
0 |
0.079 |
4 |
17 |
|
D |
35 |
11 |
11161 |
◊ |
G |
-x+2,y-1/2,-z+1 |
2_746 |
31 |
7 |
11104 |
325.7 |
-2.0 |
0.462 |
1 |
0 |
0 |
0.000 |
5 |
18 |
|
B |
32 |
8 |
11047 |
◊ |
F |
x-1,y,z |
1_455 |
31 |
7 |
10833 |
305.5 |
1.2 |
0.768 |
4 |
1 |
0 |
0.000 |
6 |
19 |
|
C |
28 |
9 |
10733 |
◊ |
A |
-x+1,y-1/2,-z+2 |
2_647 |
26 |
9 |
11167 |
281.0 |
0.1 |
0.629 |
5 |
0 |
0 |
0.000 |
20 |
|
B |
25 |
9 |
11047 |
◊ |
H |
-x+1,y-1/2,-z+2 |
2_647 |
29 |
10 |
10897 |
238.6 |
0.2 |
0.634 |
2 |
0 |
0 |
0.000 |
Average: |
259.8 |
0.1 |
0.632 |
4 |
0 |
0 |
0.000 |
7 |
21 |
|
D |
23 |
7 |
11161 |
◊ |
G |
-x+1,y-1/2,-z+1 |
2_646 |
30 |
10 |
11104 |
256.3 |
1.3 |
0.584 |
2 |
2 |
0 |
0.000 |
8 |
22 |
|
E |
36 |
10 |
10886 |
◊ |
A |
x,y,z-1 |
1_554 |
26 |
8 |
11167 |
229.8 |
0.8 |
0.777 |
5 |
3 |
0 |
0.000 |
9 |
23 |
|
B |
25 |
7 |
11047 |
◊ |
E |
x-1,y,z+1 |
1_456 |
22 |
7 |
10886 |
217.2 |
-4.1 |
0.224 |
2 |
0 |
0 |
0.000 |
24 |
|
A |
22 |
8 |
11167 |
◊ |
F |
x-1,y,z+1 |
1_456 |
26 |
7 |
10833 |
206.9 |
-3.0 |
0.330 |
5 |
0 |
0 |
0.000 |
Average: |
212.0 |
-3.5 |
0.277 |
4 |
0 |
0 |
0.000 |
10 |
25 |
|
B |
21 |
5 |
11047 |
◊ |
H |
x-1,y,z |
1_455 |
26 |
7 |
10897 |
209.8 |
2.7 |
0.863 |
2 |
1 |
0 |
0.000 |
11 |
26 |
|
C |
11 |
4 |
10733 |
◊ |
F |
-x+2,y-1/2,-z+1 |
2_746 |
20 |
5 |
10833 |
138.5 |
0.2 |
0.705 |
2 |
3 |
0 |
0.000 |
27 |
|
E |
16 |
4 |
10886 |
◊ |
H |
-x+2,y-1/2,-z+1 |
2_746 |
10 |
3 |
10897 |
111.7 |
0.4 |
0.715 |
2 |
4 |
0 |
0.000 |
Average: |
125.1 |
0.3 |
0.710 |
2 |
4 |
0 |
0.000 |
12 |
28 |
|
D |
20 |
7 |
11161 |
◊ |
H |
-x+2,y-1/2,-z+2 |
2_747 |
13 |
5 |
10897 |
131.6 |
0.8 |
0.755 |
1 |
2 |
0 |
0.000 |
13 |
29 |
|
A |
14 |
4 |
11167 |
◊ |
F |
x-1,y,z |
1_455 |
10 |
4 |
10833 |
114.5 |
-1.5 |
0.406 |
0 |
0 |
0 |
0.000 |
14 |
30 |
|
[GOL]A:901 |
6 |
1 |
220 |
◊ |
D |
x,y,z |
1_555 |
17 |
8 |
11161 |
113.9 |
0.5 |
0.684 |
2 |
0 |
0 |
0.016 |
15 |
31 |
|
[GOL]F:806 |
6 |
1 |
219 |
◊ |
D |
x,y,z |
1_555 |
17 |
7 |
11161 |
109.9 |
1.2 |
0.722 |
3 |
0 |
0 |
0.000 |
16 |
32 |
|
[GOL]A:904 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
11167 |
105.1 |
-0.1 |
0.605 |
3 |
0 |
0 |
0.062 |
17 |
33 |
|
C |
13 |
5 |
10733 |
◊ |
E |
x-1,y,z |
1_455 |
12 |
5 |
10886 |
89.2 |
1.0 |
0.807 |
0 |
3 |
0 |
0.000 |
18 |
34 |
|
[GOL]H:809 |
5 |
1 |
216 |
f |
H |
x,y,z |
1_555 |
11 |
5 |
10897 |
88.2 |
-0.8 |
0.454 |
2 |
0 |
0 |
0.057 |
19 |
35 |
|
[GOL]F:804 |
5 |
1 |
221 |
f |
F |
x,y,z |
1_555 |
13 |
5 |
10833 |
86.0 |
0.6 |
0.723 |
3 |
0 |
0 |
0.023 |
20 |
36 |
|
[GOL]A:801 |
6 |
1 |
222 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
11167 |
83.3 |
-0.4 |
0.533 |
1 |
0 |
0 |
0.039 |
21 |
37 |
|
[GOL]H:809 |
6 |
1 |
216 |
◊ |
E |
x,y,z |
1_555 |
13 |
6 |
10886 |
81.3 |
-0.8 |
0.470 |
0 |
0 |
0 |
0.029 |
22 |
38 |
|
[GOL]E:909 |
6 |
1 |
214 |
f |
C |
x,y,z |
1_555 |
10 |
3 |
10733 |
77.8 |
-0.1 |
0.660 |
4 |
0 |
0 |
0.063 |
23 |
39 |
|
[GOL]C:805 |
5 |
1 |
218 |
◊ |
C |
x,y,z |
1_555 |
11 |
5 |
10733 |
77.1 |
0.9 |
0.675 |
2 |
0 |
0 |
0.000 |
24 |
40 |
|
[GOL]E:909 |
5 |
1 |
214 |
◊ |
E |
x,y,z |
1_555 |
11 |
5 |
10886 |
75.0 |
-0.2 |
0.607 |
1 |
0 |
0 |
0.002 |
25 |
41 |
|
[GOL]F:806 |
5 |
1 |
219 |
f |
F |
x,y,z |
1_555 |
12 |
5 |
10833 |
74.9 |
-0.5 |
0.448 |
1 |
0 |
0 |
0.032 |
26 |
42 |
|
[GOL]F:804 |
6 |
1 |
221 |
◊ |
C |
x,y,z |
1_555 |
12 |
3 |
10733 |
69.6 |
-0.2 |
0.606 |
1 |
0 |
0 |
0.021 |
27 |
43 |
|
[GOL]A:902 |
4 |
1 |
222 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
11167 |
68.4 |
-0.4 |
0.441 |
0 |
0 |
0 |
0.016 |
28 |
44 |
|
[GOL]A:802 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
11167 |
66.3 |
0.6 |
0.689 |
2 |
0 |
0 |
0.012 |
29 |
45 |
|
[GOL]A:802 |
4 |
1 |
219 |
◊ |
C |
x,y,z |
1_555 |
14 |
4 |
10733 |
64.5 |
0.8 |
0.714 |
1 |
0 |
0 |
0.000 |
30 |
46 |
|
[GOL]A:901 |
4 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
11167 |
64.3 |
-0.2 |
0.537 |
1 |
0 |
0 |
0.030 |
31 |
47 |
|
[GOL]C:807 |
5 |
1 |
218 |
f |
C |
x,y,z |
1_555 |
11 |
5 |
10733 |
63.4 |
0.1 |
0.610 |
2 |
0 |
0 |
0.025 |
32 |
48 |
|
B |
9 |
3 |
11047 |
◊ |
D |
x-1,y,z |
1_455 |
9 |
3 |
11161 |
60.5 |
-1.1 |
0.407 |
0 |
0 |
0 |
0.000 |
33 |
49 |
|
[GOL]A:803 |
4 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
11167 |
57.6 |
0.3 |
0.602 |
1 |
0 |
0 |
0.007 |
34 |
50 |
|
E |
3 |
2 |
10886 |
◊ |
G |
-x+2,y-1/2,-z+1 |
2_746 |
3 |
1 |
11104 |
48.6 |
0.5 |
0.710 |
0 |
0 |
0 |
0.000 |
51 |
|
D |
1 |
1 |
11161 |
◊ |
F |
-x+2,y-1/2,-z+1 |
2_746 |
1 |
1 |
10833 |
1.6 |
0.0 |
0.705 |
0 |
0 |
0 |
0.000 |
Average: |
25.1 |
0.3 |
0.707 |
0 |
0 |
0 |
0.000 |
35 |
52 |
|
[CA]B:999 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
11047 |
37.7 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.253 |
53 |
|
[CA]D:1020 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
11167 |
30.5 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.253 |
54 |
|
[CA]C:161 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
4 |
2 |
10733 |
22.9 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.253 |
55 |
|
[CA]E:216 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
5 |
3 |
10886 |
22.1 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.253 |
56 |
|
[CA]B:978 |
1 |
1 |
85 |
f |
G |
x,y,z |
1_555 |
4 |
3 |
11104 |
16.1 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.253 |
57 |
|
[CA]E:227 |
1 |
1 |
85 |
f |
H |
x,y,z |
1_555 |
4 |
3 |
10897 |
14.4 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.253 |
Average: |
24.0 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.253 |
36 |
58 |
|
[CA]B:961 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
11047 |
35.5 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.189 |
59 |
|
[CA]F:932 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
7 |
3 |
10833 |
31.7 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.189 |
60 |
|
[CA]F:1050 |
1 |
1 |
85 |
f |
H |
x,y,z |
1_555 |
4 |
2 |
10897 |
29.6 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.189 |
Average: |
32.3 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.189 |
37 |
61 |
|
F |
5 |
3 |
10833 |
◊ |
H |
x,y,z-1 |
1_554 |
6 |
3 |
10897 |
34.6 |
0.7 |
0.794 |
0 |
0 |
0 |
0.000 |
38 |
62 |
|
C |
2 |
1 |
10733 |
◊ |
G |
-x+1,y-1/2,-z+1 |
2_646 |
4 |
1 |
11104 |
34.4 |
-0.8 |
0.238 |
0 |
0 |
0 |
0.000 |
39 |
63 |
|
[GOL]C:807 |
3 |
1 |
218 |
◊ |
D |
x,y,z |
1_555 |
4 |
1 |
11161 |
33.4 |
1.3 |
0.834 |
1 |
0 |
0 |
0.000 |
40 |
64 |
|
[CA]F:932 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
5 |
3 |
11161 |
31.7 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.036 |
65 |
|
[CA]B:961 |
1 |
1 |
85 |
◊ |
H |
x,y,z |
1_555 |
5 |
2 |
10897 |
27.4 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.036 |
66 |
|
[CA]F:1050 |
1 |
1 |
85 |
◊ |
F |
x,y,z |
1_555 |
4 |
1 |
10833 |
25.9 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.036 |
Average: |
28.3 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.036 |
41 |
67 |
|
D |
3 |
2 |
11161 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
1 |
11167 |
31.4 |
0.7 |
0.838 |
1 |
0 |
0 |
0.000 |
42 |
68 |
|
[GOL]A:801 |
4 |
1 |
222 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
11047 |
30.9 |
-0.2 |
0.552 |
0 |
0 |
0 |
0.003 |
43 |
69 |
|
[CA]C:161 |
1 |
1 |
85 |
◊ |
F |
x,y,z |
1_555 |
6 |
2 |
10833 |
30.3 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.251 |
70 |
|
[CA]B:978 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
7 |
2 |
11047 |
27.5 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.251 |
71 |
|
[CA]E:227 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
8 |
3 |
10886 |
27.2 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.251 |
72 |
|
[CA]B:999 |
1 |
1 |
85 |
◊ |
G |
x,y,z |
1_555 |
3 |
2 |
11104 |
25.8 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.251 |
73 |
|
[CA]D:1020 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
11161 |
24.8 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.251 |
74 |
|
[CA]E:216 |
1 |
1 |
85 |
◊ |
H |
x,y,z |
1_555 |
3 |
1 |
10897 |
15.1 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.251 |
Average: |
25.1 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.251 |
44 |
75 |
|
H |
3 |
1 |
10897 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
11167 |
27.6 |
0.4 |
0.758 |
0 |
0 |
0 |
0.000 |
76 |
|
E |
3 |
1 |
10886 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
11161 |
25.3 |
0.4 |
0.766 |
0 |
0 |
0 |
0.000 |
77 |
|
C |
4 |
1 |
10733 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
11047 |
23.2 |
0.1 |
0.684 |
0 |
0 |
0 |
0.000 |
78 |
|
G |
3 |
1 |
11104 |
◊ |
F |
x,y,z |
1_555 |
2 |
1 |
10833 |
5.4 |
0.0 |
0.654 |
0 |
0 |
0 |
0.000 |
Average: |
20.4 |
0.2 |
0.716 |
0 |
0 |
0 |
0.000 |
45 |
79 |
|
[GOL]A:902 |
4 |
1 |
222 |
◊ |
E |
x-1,y,z |
1_455 |
3 |
1 |
10886 |
23.6 |
0.2 |
0.615 |
1 |
0 |
0 |
0.000 |
46 |
80 |
|
C |
2 |
1 |
10733 |
◊ |
F |
x-1,y,z |
1_455 |
2 |
2 |
10833 |
23.5 |
1.0 |
0.855 |
1 |
0 |
0 |
0.000 |
47 |
81 |
|
D |
2 |
1 |
11161 |
◊ |
G |
-x+2,y-1/2,-z+2 |
2_747 |
2 |
1 |
11104 |
19.9 |
0.1 |
0.591 |
0 |
0 |
0 |
0.000 |
48 |
82 |
|
B |
3 |
1 |
11047 |
◊ |
H |
-x+2,y-1/2,-z+2 |
2_747 |
2 |
2 |
10897 |
18.8 |
-0.6 |
0.318 |
0 |
0 |
0 |
0.000 |
49 |
83 |
|
[GOL]C:805 |
2 |
1 |
218 |
f |
D |
x,y,z |
1_555 |
3 |
1 |
11161 |
18.7 |
0.4 |
0.687 |
1 |
0 |
0 |
0.100 |
50 |
84 |
|
A |
3 |
2 |
11167 |
◊ |
H |
x-1,y,z |
1_455 |
4 |
2 |
10897 |
17.3 |
0.6 |
0.798 |
0 |
0 |
0 |
0.000 |
51 |
85 |
|
[GOL]A:803 |
1 |
1 |
219 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
11161 |
17.0 |
0.2 |
0.554 |
0 |
0 |
0 |
0.000 |
52 |
86 |
|
A |
3 |
1 |
11167 |
◊ |
E |
x-1,y,z |
1_455 |
2 |
1 |
10886 |
10.6 |
-0.3 |
0.469 |
0 |
0 |
0 |
0.000 |
53 |
87 |
|
[CA]F:932 |
1 |
1 |
85 |
f |
[GOL]F:806 |
x,y,z |
1_555 |
2 |
1 |
219 |
6.1 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.033 |
54 |
88 |
|
B |
3 |
2 |
11047 |
x |
B |
x-1,y,z |
1_455 |
1 |
1 |
11047 |
2.6 |
0.1 |
0.694 |
0 |
0 |
0 |
0.000 |
55 |
89 |
|
A |
1 |
1 |
11167 |
◊ |
E |
x-1,y,z+1 |
1_456 |
1 |
1 |
10886 |
2.3 |
0.0 |
0.604 |
0 |
0 |
0 |
0.000 |
56 |
90 |
|
E |
1 |
1 |
10886 |
◊ |
[GOL]A:904 |
x,y,z-1 |
1_554 |
1 |
1 |
220 |
1.8 |
0.1 |
0.606 |
0 |
0 |
0 |
0.000 |
|