## |
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 |
192 |
44 |
5883 |
◊ |
A |
x,y,z |
1_555 |
210 |
48 |
16221 |
1975.9 |
-37.0 |
0.027 |
16 |
5 |
0 |
0.787 |
2 |
|
D |
196 |
44 |
5957 |
◊ |
C |
x,y,z |
1_555 |
214 |
48 |
16204 |
1970.1 |
-35.9 |
0.038 |
13 |
5 |
0 |
0.787 |
Average: |
1973.0 |
-36.5 |
0.033 |
15 |
5 |
0 |
0.787 |
2 |
3 |
|
F |
53 |
9 |
1317 |
◊ |
C |
x,y,z |
1_555 |
99 |
34 |
16204 |
714.8 |
-10.8 |
0.338 |
9 |
0 |
0 |
0.519 |
4 |
|
E |
53 |
9 |
1319 |
◊ |
A |
x,y,z |
1_555 |
105 |
35 |
16221 |
698.4 |
-11.2 |
0.314 |
9 |
0 |
0 |
0.519 |
Average: |
706.6 |
-11.0 |
0.326 |
9 |
0 |
0 |
0.519 |
3 |
5 |
|
A |
70 |
18 |
16221 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
59 |
18 |
16204 |
605.8 |
0.9 |
0.721 |
16 |
6 |
0 |
0.000 |
6 |
|
A |
55 |
17 |
16221 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
70 |
18 |
16204 |
597.6 |
0.4 |
0.703 |
15 |
5 |
0 |
0.000 |
Average: |
601.7 |
0.6 |
0.712 |
16 |
6 |
0 |
0.000 |
4 |
7 |
|
C |
36 |
13 |
16204 |
◊ |
D |
x,y,z-1 |
1_554 |
34 |
8 |
5957 |
347.7 |
-3.7 |
0.278 |
4 |
5 |
0 |
0.000 |
8 |
|
A |
37 |
13 |
16221 |
◊ |
B |
x,y,z-1 |
1_554 |
35 |
8 |
5883 |
347.7 |
-3.5 |
0.301 |
4 |
5 |
0 |
0.000 |
Average: |
347.7 |
-3.6 |
0.289 |
4 |
5 |
0 |
0.000 |
5 |
9 |
|
D |
30 |
7 |
5957 |
◊ |
C |
x-1,y,z |
1_455 |
29 |
11 |
16204 |
269.3 |
-4.0 |
0.326 |
0 |
0 |
0 |
0.000 |
10 |
|
A |
21 |
9 |
16221 |
◊ |
B |
x-1,y,z |
1_455 |
23 |
7 |
5883 |
213.9 |
-3.1 |
0.361 |
0 |
0 |
0 |
0.000 |
Average: |
241.6 |
-3.6 |
0.344 |
0 |
0 |
0 |
0.000 |
6 |
11 |
|
C |
23 |
7 |
16204 |
◊ |
A |
x,y,z |
1_555 |
25 |
10 |
16221 |
206.4 |
0.6 |
0.635 |
2 |
1 |
0 |
0.000 |
7 |
12 |
|
[SIN]C:602 |
8 |
1 |
251 |
f |
C |
x,y,z |
1_555 |
29 |
15 |
16204 |
143.8 |
1.8 |
0.388 |
4 |
0 |
0 |
0.000 |
8 |
13 |
|
[SIN]A:603 |
8 |
1 |
253 |
f |
A |
x,y,z |
1_555 |
30 |
15 |
16221 |
133.0 |
2.2 |
0.474 |
3 |
0 |
0 |
0.000 |
9 |
14 |
|
B |
17 |
4 |
5883 |
◊ |
F |
-x+1,y-1/2,-z+1 |
2_646 |
11 |
3 |
1317 |
130.0 |
-0.0 |
0.836 |
2 |
2 |
0 |
0.000 |
15 |
|
E |
11 |
3 |
1319 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
17 |
4 |
5957 |
126.6 |
-0.1 |
0.834 |
2 |
2 |
0 |
0.000 |
Average: |
128.3 |
-0.1 |
0.835 |
2 |
2 |
0 |
0.000 |
10 |
16 |
|
C |
8 |
3 |
16204 |
x |
C |
x,y,z-1 |
1_554 |
10 |
5 |
16204 |
92.6 |
0.6 |
0.737 |
1 |
3 |
0 |
0.000 |
17 |
|
A |
7 |
3 |
16221 |
x |
A |
x,y,z-1 |
1_554 |
10 |
5 |
16221 |
90.1 |
0.7 |
0.754 |
1 |
3 |
0 |
0.000 |
Average: |
91.3 |
0.7 |
0.745 |
1 |
3 |
0 |
0.000 |
11 |
18 |
|
C |
11 |
5 |
16204 |
x |
C |
x-1,y,z |
1_455 |
12 |
5 |
16204 |
67.2 |
-0.8 |
0.452 |
0 |
0 |
0 |
0.000 |
19 |
|
A |
8 |
3 |
16221 |
x |
A |
x-1,y,z |
1_455 |
8 |
3 |
16221 |
65.9 |
0.1 |
0.563 |
0 |
0 |
0 |
0.000 |
Average: |
66.6 |
-0.4 |
0.507 |
0 |
0 |
0 |
0.000 |
12 |
20 |
|
A |
9 |
3 |
16221 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
9 |
4 |
5957 |
65.4 |
-0.2 |
0.667 |
1 |
0 |
0 |
0.000 |
21 |
|
B |
8 |
3 |
5883 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
7 |
2 |
16204 |
62.2 |
-0.1 |
0.664 |
1 |
0 |
0 |
0.000 |
Average: |
63.8 |
-0.2 |
0.666 |
1 |
0 |
0 |
0.000 |
13 |
22 |
|
[FE]C:601 |
1 |
1 |
137 |
f |
C |
x,y,z |
1_555 |
10 |
7 |
16204 |
53.7 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.295 |
23 |
|
[FE]A:601 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
12 |
8 |
16221 |
45.5 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.295 |
Average: |
49.6 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.295 |
14 |
24 |
|
[NO]A:602 |
2 |
1 |
133 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
16221 |
48.0 |
-1.5 |
0.524 |
0 |
0 |
0 |
0.048 |
15 |
25 |
|
[SIN]C:602 |
3 |
1 |
251 |
f |
[FE]C:601 |
x,y,z |
1_555 |
1 |
1 |
137 |
34.4 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.110 |
16 |
26 |
|
[NO]A:602 |
2 |
1 |
133 |
◊ |
E |
x,y,z |
1_555 |
9 |
2 |
1319 |
32.4 |
-1.4 |
0.751 |
0 |
0 |
0 |
0.046 |
17 |
27 |
|
C |
3 |
2 |
16204 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
1 |
5883 |
31.1 |
0.7 |
0.590 |
0 |
1 |
0 |
0.000 |
18 |
28 |
|
[SIN]A:603 |
4 |
1 |
253 |
f |
[FE]A:601 |
x,y,z |
1_555 |
1 |
1 |
137 |
28.0 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.089 |
19 |
29 |
|
[SIN]C:602 |
3 |
1 |
251 |
◊ |
F |
x,y,z |
1_555 |
2 |
1 |
1317 |
27.0 |
0.0 |
0.317 |
0 |
0 |
0 |
0.000 |
20 |
30 |
|
[NO]A:602 |
2 |
1 |
133 |
f |
[FE]A:601 |
x,y,z |
1_555 |
1 |
1 |
137 |
25.5 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.082 |
21 |
31 |
|
[SIN]A:603 |
4 |
1 |
253 |
f |
[NO]A:602 |
x,y,z |
1_555 |
1 |
1 |
133 |
22.5 |
0.3 |
0.280 |
0 |
0 |
0 |
0.000 |
22 |
32 |
|
[SIN]A:603 |
3 |
1 |
253 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
1319 |
22.4 |
0.0 |
0.276 |
0 |
0 |
0 |
0.000 |
23 |
33 |
|
A |
4 |
1 |
16221 |
x |
A |
x-1,y,z-1 |
1_454 |
3 |
1 |
16221 |
20.9 |
0.5 |
0.722 |
0 |
0 |
0 |
0.000 |
34 |
|
C |
3 |
1 |
16204 |
x |
C |
x-1,y,z+1 |
1_456 |
4 |
1 |
16204 |
19.8 |
0.5 |
0.720 |
0 |
0 |
0 |
0.000 |
Average: |
20.3 |
0.5 |
0.721 |
0 |
0 |
0 |
0.000 |
24 |
35 |
|
[FE]C:601 |
1 |
1 |
137 |
◊ |
F |
x,y,z |
1_555 |
2 |
1 |
1317 |
19.6 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.078 |
36 |
|
[FE]A:601 |
1 |
1 |
137 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
1319 |
17.5 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.078 |
Average: |
18.5 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.078 |
25 |
37 |
|
A |
1 |
1 |
16221 |
◊ |
C |
x,y,z-1 |
1_554 |
1 |
1 |
16204 |
19.0 |
0.4 |
0.326 |
0 |
0 |
0 |
0.000 |
26 |
38 |
|
A |
3 |
3 |
16221 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
5 |
2 |
16204 |
15.8 |
0.2 |
0.692 |
0 |
0 |
0 |
0.000 |
39 |
|
A |
5 |
2 |
16221 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
2 |
16204 |
13.0 |
0.1 |
0.694 |
0 |
0 |
0 |
0.000 |
Average: |
14.4 |
0.2 |
0.693 |
0 |
0 |
0 |
0.000 |
27 |
40 |
|
A |
2 |
1 |
16221 |
◊ |
B |
x-1,y,z-1 |
1_454 |
2 |
1 |
5883 |
14.5 |
-0.5 |
0.328 |
0 |
0 |
0 |
0.000 |
41 |
|
D |
2 |
1 |
5957 |
◊ |
C |
x-1,y,z+1 |
1_456 |
2 |
1 |
16204 |
13.0 |
-0.4 |
0.355 |
0 |
0 |
0 |
0.000 |
Average: |
13.8 |
-0.4 |
0.342 |
0 |
0 |
0 |
0.000 |
28 |
42 |
|
B |
4 |
3 |
5883 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
2 |
16204 |
10.6 |
-0.1 |
0.502 |
0 |
0 |
0 |
0.000 |
43 |
|
A |
2 |
2 |
16221 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
4 |
3 |
5957 |
7.8 |
-0.1 |
0.541 |
0 |
0 |
0 |
0.000 |
Average: |
9.2 |
-0.1 |
0.522 |
0 |
0 |
0 |
0.000 |
|