## |
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 |
161 |
44 |
12049 |
◊ |
E |
x,y,z |
1_555 |
161 |
44 |
11491 |
1576.9 |
-32.5 |
0.008 |
13 |
0 |
0 |
0.513 |
2 |
|
B |
158 |
43 |
11600 |
◊ |
A |
x,y,z |
1_555 |
159 |
43 |
11584 |
1568.7 |
-32.4 |
0.008 |
12 |
0 |
0 |
0.513 |
3 |
|
D |
164 |
44 |
11806 |
◊ |
C |
x,y,z |
1_555 |
163 |
44 |
11665 |
1565.1 |
-31.9 |
0.018 |
13 |
0 |
0 |
0.513 |
4 |
|
H |
162 |
44 |
11542 |
◊ |
G |
x,y,z |
1_555 |
163 |
43 |
11551 |
1560.1 |
-31.9 |
0.018 |
13 |
0 |
0 |
0.513 |
Average: |
1567.7 |
-32.2 |
0.013 |
13 |
0 |
0 |
0.513 |
2 |
5 |
|
C |
139 |
38 |
11665 |
◊ |
B |
x,y,z |
1_555 |
143 |
38 |
11600 |
1359.9 |
-14.2 |
0.477 |
13 |
4 |
0 |
0.194 |
6 |
|
G |
139 |
38 |
11551 |
◊ |
F |
x,y,z |
1_555 |
138 |
37 |
12049 |
1358.0 |
-12.8 |
0.519 |
15 |
5 |
0 |
0.194 |
7 |
|
H |
141 |
39 |
11542 |
◊ |
E |
x,y,z |
1_555 |
136 |
38 |
11491 |
1357.8 |
-14.8 |
0.443 |
15 |
4 |
0 |
0.194 |
8 |
|
D |
140 |
38 |
11806 |
◊ |
A |
x,y,z |
1_555 |
136 |
37 |
11584 |
1348.5 |
-12.7 |
0.534 |
14 |
4 |
0 |
0.194 |
Average: |
1356.1 |
-13.6 |
0.493 |
14 |
4 |
0 |
0.194 |
3 |
9 |
|
[NAD]H:279 |
44 |
1 |
822 |
f |
H |
x,y,z |
1_555 |
83 |
35 |
11542 |
587.8 |
-7.9 |
0.626 |
15 |
0 |
0 |
0.386 |
10 |
|
[NAD]E:279 |
43 |
1 |
820 |
f |
E |
x,y,z |
1_555 |
84 |
35 |
11491 |
587.2 |
-7.7 |
0.625 |
13 |
0 |
0 |
0.386 |
11 |
|
[NAD]A:279 |
44 |
1 |
822 |
f |
A |
x,y,z |
1_555 |
82 |
34 |
11584 |
586.9 |
-7.8 |
0.617 |
15 |
0 |
0 |
0.386 |
12 |
|
[NAD]D:279 |
44 |
1 |
820 |
f |
D |
x,y,z |
1_555 |
81 |
34 |
11806 |
586.5 |
-8.0 |
0.620 |
13 |
0 |
0 |
0.386 |
13 |
|
[NAD]G:279 |
44 |
1 |
818 |
f |
G |
x,y,z |
1_555 |
81 |
35 |
11551 |
584.2 |
-7.7 |
0.633 |
14 |
0 |
0 |
0.386 |
14 |
|
[NAD]C:279 |
41 |
1 |
822 |
f |
C |
x,y,z |
1_555 |
82 |
35 |
11665 |
581.6 |
-7.5 |
0.631 |
14 |
0 |
0 |
0.386 |
15 |
|
[NAD]F:279 |
43 |
1 |
817 |
f |
F |
x,y,z |
1_555 |
80 |
32 |
12049 |
581.5 |
-7.5 |
0.606 |
13 |
0 |
0 |
0.386 |
16 |
|
[NAD]B:279 |
44 |
1 |
817 |
f |
B |
x,y,z |
1_555 |
80 |
33 |
11600 |
581.1 |
-7.8 |
0.627 |
13 |
0 |
0 |
0.386 |
Average: |
584.6 |
-7.7 |
0.623 |
14 |
0 |
0 |
0.386 |
4 |
17 |
|
C |
39 |
10 |
11665 |
◊ |
A |
x,y,z |
1_555 |
38 |
10 |
11584 |
370.3 |
-7.6 |
0.144 |
2 |
0 |
0 |
0.077 |
18 |
|
D |
40 |
10 |
11806 |
◊ |
B |
x,y,z |
1_555 |
39 |
10 |
11600 |
367.3 |
-7.5 |
0.169 |
2 |
0 |
0 |
0.077 |
19 |
|
G |
37 |
10 |
11551 |
◊ |
E |
x,y,z |
1_555 |
38 |
10 |
11491 |
363.8 |
-7.5 |
0.140 |
2 |
0 |
0 |
0.077 |
20 |
|
H |
38 |
10 |
11542 |
◊ |
F |
x,y,z |
1_555 |
37 |
10 |
12049 |
362.9 |
-7.3 |
0.153 |
2 |
0 |
0 |
0.077 |
Average: |
366.1 |
-7.5 |
0.152 |
2 |
0 |
0 |
0.077 |
5 |
21 |
|
C |
38 |
9 |
11665 |
◊ |
H |
x-1,y,z |
1_455 |
38 |
10 |
11542 |
353.7 |
-2.3 |
0.675 |
3 |
4 |
0 |
0.000 |
22 |
|
D |
35 |
10 |
11806 |
◊ |
G |
x-1,y-1,z+1 |
1_446 |
34 |
9 |
11551 |
331.5 |
-2.7 |
0.585 |
3 |
4 |
0 |
0.000 |
Average: |
342.6 |
-2.5 |
0.630 |
3 |
4 |
0 |
0.000 |
6 |
23 |
|
B |
31 |
9 |
11600 |
◊ |
G |
x,y-1,z |
1_545 |
36 |
12 |
11551 |
300.5 |
-0.5 |
0.781 |
3 |
2 |
0 |
0.000 |
7 |
24 |
|
C |
27 |
11 |
11665 |
◊ |
B |
x-1,y,z |
1_455 |
24 |
11 |
11600 |
225.9 |
-0.5 |
0.703 |
3 |
2 |
0 |
0.000 |
25 |
|
F |
25 |
11 |
12049 |
◊ |
G |
x-1,y,z |
1_455 |
25 |
11 |
11551 |
224.9 |
-0.3 |
0.748 |
3 |
2 |
0 |
0.000 |
Average: |
225.4 |
-0.4 |
0.725 |
3 |
2 |
0 |
0.000 |
8 |
26 |
|
E |
27 |
11 |
11491 |
◊ |
B |
x,y,z |
1_555 |
28 |
11 |
11600 |
205.7 |
-0.3 |
0.782 |
0 |
0 |
0 |
0.000 |
27 |
|
A |
27 |
11 |
11584 |
◊ |
F |
x,y-1,z+1 |
1_546 |
25 |
8 |
12049 |
195.8 |
-0.4 |
0.746 |
0 |
0 |
0 |
0.000 |
Average: |
200.8 |
-0.4 |
0.764 |
0 |
0 |
0 |
0.000 |
9 |
28 |
|
C |
22 |
10 |
11665 |
◊ |
F |
x,y-1,z |
1_545 |
19 |
8 |
12049 |
183.4 |
-0.0 |
0.629 |
1 |
0 |
0 |
0.000 |
10 |
29 |
|
E |
21 |
7 |
11491 |
◊ |
H |
x-1,y,z |
1_455 |
22 |
7 |
11542 |
166.9 |
0.2 |
0.814 |
0 |
0 |
0 |
0.000 |
30 |
|
D |
20 |
7 |
11806 |
◊ |
A |
x-1,y,z |
1_455 |
19 |
7 |
11584 |
162.0 |
0.8 |
0.775 |
1 |
0 |
0 |
0.000 |
Average: |
164.5 |
0.5 |
0.794 |
1 |
0 |
0 |
0.000 |
11 |
31 |
|
E |
20 |
7 |
11491 |
◊ |
A |
x,y,z-1 |
1_554 |
14 |
5 |
11584 |
136.2 |
0.1 |
0.774 |
2 |
2 |
0 |
0.000 |
12 |
32 |
|
[CA]F:281 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
11 |
6 |
12049 |
45.1 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.115 |
33 |
|
[CA]B:280 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
11600 |
45.0 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.115 |
Average: |
45.1 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.115 |
13 |
34 |
|
[CA]D:280 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
4 |
2 |
11806 |
39.4 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.112 |
35 |
|
[CA]H:280 |
1 |
1 |
85 |
f |
H |
x,y,z |
1_555 |
4 |
2 |
11542 |
38.2 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.112 |
Average: |
38.8 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.112 |
14 |
36 |
|
A |
11 |
5 |
11584 |
f |
[CA]F:280 |
x,y-1,z+1 |
1_546 |
1 |
1 |
85 |
37.4 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.137 |
37 |
|
[CA]E:280 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
11600 |
35.1 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.137 |
38 |
|
[CA]A:280 |
1 |
1 |
85 |
f |
F |
x,y-1,z+1 |
1_546 |
11 |
5 |
12049 |
35.1 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.137 |
39 |
|
[CA]B:281 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
8 |
5 |
11491 |
31.5 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.137 |
Average: |
34.8 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.137 |
15 |
40 |
|
D |
6 |
5 |
11806 |
◊ |
H |
x-1,y,z+1 |
1_456 |
7 |
4 |
11542 |
35.8 |
0.4 |
0.729 |
0 |
0 |
0 |
0.000 |
16 |
41 |
|
[CA]E:280 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
4 |
2 |
11491 |
31.4 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.000 |
42 |
|
[CA]A:280 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
11584 |
31.0 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.000 |
43 |
|
[CA]F:280 |
1 |
1 |
85 |
◊ |
F |
x,y,z |
1_555 |
3 |
1 |
12049 |
29.0 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.000 |
44 |
|
[CA]B:281 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
11600 |
28.7 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
30.0 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.000 |
17 |
45 |
|
E |
2 |
2 |
11491 |
◊ |
G |
x-1,y,z |
1_455 |
2 |
2 |
11551 |
25.0 |
0.2 |
0.652 |
0 |
0 |
0 |
0.000 |
46 |
|
C |
4 |
2 |
11665 |
◊ |
A |
x-1,y,z |
1_455 |
2 |
2 |
11584 |
19.8 |
0.1 |
0.658 |
0 |
0 |
0 |
0.000 |
Average: |
22.4 |
0.2 |
0.655 |
0 |
0 |
0 |
0.000 |
18 |
47 |
|
C |
4 |
2 |
11665 |
◊ |
[CA]H:280 |
x-1,y,z |
1_455 |
1 |
1 |
85 |
19.6 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.000 |
48 |
|
[CA]D:280 |
1 |
1 |
85 |
◊ |
G |
x-1,y-1,z+1 |
1_446 |
4 |
2 |
11551 |
18.8 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
19.2 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.000 |
19 |
49 |
|
[CA]B:280 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
11491 |
10.9 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.000 |
50 |
|
A |
3 |
1 |
11584 |
◊ |
[CA]F:281 |
x,y-1,z+1 |
1_546 |
1 |
1 |
85 |
10.5 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
10.7 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
20 |
51 |
|
H |
4 |
1 |
11542 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
11600 |
8.9 |
-0.1 |
0.627 |
0 |
0 |
0 |
0.000 |
|