## |
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 |
|
E |
86 |
29 |
12005 |
◊ |
A |
x,y,z |
1_555 |
86 |
30 |
11874 |
728.1 |
-4.5 |
0.480 |
13 |
6 |
0 |
0.000 |
2 |
|
C |
87 |
30 |
12073 |
◊ |
D |
x,y-1,z |
1_545 |
88 |
29 |
11801 |
726.0 |
-4.5 |
0.486 |
13 |
2 |
0 |
0.000 |
Average: |
727.1 |
-4.5 |
0.483 |
13 |
4 |
0 |
0.000 |
2 |
3 |
|
D |
77 |
19 |
11801 |
◊ |
B |
x,y,z |
1_555 |
74 |
19 |
12201 |
621.6 |
-5.8 |
0.319 |
6 |
2 |
0 |
0.000 |
4 |
|
C |
75 |
18 |
12073 |
◊ |
E |
x-1,y,z |
1_455 |
73 |
17 |
12005 |
611.2 |
-6.1 |
0.328 |
6 |
4 |
0 |
0.000 |
5 |
|
F |
70 |
16 |
12064 |
◊ |
A |
x,y,z |
1_555 |
69 |
16 |
11874 |
607.6 |
-8.0 |
0.158 |
4 |
0 |
0 |
0.000 |
Average: |
613.5 |
-6.7 |
0.268 |
5 |
2 |
0 |
0.000 |
3 |
6 |
|
E |
46 |
13 |
12005 |
◊ |
B |
x,y-1,z |
1_545 |
45 |
13 |
12201 |
422.4 |
1.2 |
0.787 |
4 |
2 |
0 |
0.000 |
4 |
7 |
|
F |
47 |
13 |
12064 |
◊ |
A |
x-1,y,z |
1_455 |
40 |
11 |
11874 |
415.8 |
-2.4 |
0.419 |
2 |
1 |
0 |
0.000 |
8 |
|
E |
37 |
11 |
12005 |
◊ |
C |
x,y,z |
1_555 |
43 |
11 |
12073 |
394.7 |
-1.7 |
0.533 |
3 |
1 |
0 |
0.000 |
9 |
|
D |
40 |
11 |
11801 |
◊ |
B |
x-1,y,z |
1_455 |
41 |
12 |
12201 |
392.5 |
-2.1 |
0.471 |
3 |
1 |
0 |
0.000 |
Average: |
401.0 |
-2.1 |
0.474 |
3 |
1 |
0 |
0.000 |
5 |
10 |
|
E |
31 |
8 |
12005 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
31 |
9 |
11801 |
283.7 |
0.5 |
0.729 |
2 |
1 |
0 |
0.000 |
6 |
11 |
|
E |
29 |
7 |
12005 |
◊ |
B |
x,y,z |
1_555 |
24 |
7 |
12201 |
224.5 |
3.0 |
0.896 |
3 |
1 |
0 |
0.000 |
7 |
12 |
|
F |
31 |
12 |
12064 |
◊ |
C |
x,y,z |
1_555 |
32 |
12 |
12073 |
214.0 |
0.9 |
0.748 |
0 |
0 |
0 |
0.000 |
8 |
13 |
|
B |
20 |
8 |
12201 |
◊ |
A |
x,y,z |
1_555 |
24 |
8 |
11874 |
199.0 |
2.5 |
0.851 |
5 |
2 |
0 |
0.000 |
9 |
14 |
|
F |
21 |
11 |
12064 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
23 |
8 |
12201 |
182.8 |
-0.9 |
0.525 |
1 |
0 |
0 |
0.000 |
10 |
15 |
|
[AKG]E:301 |
10 |
1 |
290 |
f |
E |
x,y,z |
1_555 |
28 |
15 |
12005 |
168.3 |
1.0 |
0.378 |
7 |
0 |
0 |
0.011 |
11 |
16 |
|
[AKG]D:302 |
10 |
1 |
288 |
f |
D |
x,y,z |
1_555 |
28 |
15 |
11801 |
167.5 |
0.9 |
0.378 |
7 |
0 |
0 |
0.011 |
17 |
|
[AKG]C:301 |
10 |
1 |
286 |
f |
C |
x,y,z |
1_555 |
28 |
15 |
12073 |
166.6 |
1.0 |
0.383 |
7 |
0 |
0 |
0.011 |
18 |
|
[AKG]F:301 |
10 |
1 |
287 |
f |
F |
x,y,z |
1_555 |
29 |
15 |
12064 |
165.5 |
1.1 |
0.379 |
7 |
0 |
0 |
0.011 |
19 |
|
[AKG]A:301 |
10 |
1 |
285 |
f |
A |
x,y,z |
1_555 |
26 |
15 |
11874 |
165.3 |
0.9 |
0.365 |
6 |
0 |
0 |
0.011 |
Average: |
166.2 |
1.0 |
0.376 |
7 |
0 |
0 |
0.011 |
12 |
20 |
|
[AKG]B:302 |
10 |
1 |
289 |
f |
B |
x,y,z |
1_555 |
28 |
15 |
12201 |
166.1 |
1.0 |
0.375 |
7 |
0 |
0 |
0.011 |
13 |
21 |
|
C |
17 |
5 |
12073 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
18 |
7 |
11801 |
117.1 |
0.4 |
0.565 |
0 |
0 |
0 |
0.000 |
14 |
22 |
|
E |
13 |
5 |
12005 |
◊ |
D |
x,y,z |
1_555 |
10 |
3 |
11801 |
105.3 |
2.1 |
0.827 |
2 |
0 |
0 |
0.000 |
15 |
23 |
|
C |
11 |
5 |
12073 |
x |
C |
-x,y-1/2,-z+1/2 |
3_545 |
9 |
4 |
12073 |
82.5 |
1.3 |
0.837 |
0 |
0 |
0 |
0.000 |
16 |
24 |
|
D |
10 |
5 |
11801 |
◊ |
A |
x,y,z |
1_555 |
10 |
3 |
11874 |
81.8 |
0.8 |
0.753 |
0 |
1 |
0 |
0.000 |
17 |
25 |
|
[FE]E:300 |
1 |
1 |
137 |
cf |
E |
x,y,z |
1_555 |
13 |
7 |
12005 |
58.7 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.060 |
26 |
|
[FE]C:300 |
1 |
1 |
137 |
cf |
C |
x,y,z |
1_555 |
12 |
6 |
12073 |
58.6 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.060 |
27 |
|
[FE]A:300 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
11874 |
58.4 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.060 |
28 |
|
[FE]F:300 |
1 |
1 |
137 |
f |
F |
x,y,z |
1_555 |
12 |
7 |
12064 |
58.2 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.060 |
29 |
|
[FE]D:301 |
1 |
1 |
137 |
f |
D |
x,y,z |
1_555 |
13 |
7 |
11801 |
58.0 |
-10.1 |
0.000 |
0 |
0 |
0 |
0.060 |
30 |
|
[FE]B:301 |
1 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
12201 |
57.1 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.060 |
Average: |
58.1 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.060 |
18 |
31 |
|
F |
5 |
2 |
12064 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
6 |
3 |
11874 |
51.3 |
-0.5 |
0.452 |
0 |
0 |
0 |
0.000 |
19 |
32 |
|
A |
7 |
3 |
11874 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
6 |
2 |
12201 |
50.7 |
-0.5 |
0.417 |
0 |
0 |
0 |
0.000 |
20 |
33 |
|
F |
5 |
2 |
12064 |
◊ |
D |
x,y-1,z |
1_545 |
5 |
2 |
11801 |
45.1 |
1.1 |
0.859 |
0 |
0 |
0 |
0.000 |
34 |
|
A |
6 |
2 |
11874 |
◊ |
B |
x,y-1,z |
1_545 |
4 |
2 |
12201 |
29.3 |
0.4 |
0.735 |
0 |
0 |
0 |
0.000 |
Average: |
37.2 |
0.7 |
0.797 |
0 |
0 |
0 |
0.000 |
21 |
35 |
|
[AKG]E:301 |
4 |
1 |
290 |
cf |
[FE]E:300 |
x,y,z |
1_555 |
1 |
1 |
137 |
43.9 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.030 |
36 |
|
[AKG]B:302 |
4 |
1 |
289 |
f |
[FE]B:301 |
x,y,z |
1_555 |
1 |
1 |
137 |
43.9 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.030 |
37 |
|
[AKG]D:302 |
4 |
1 |
288 |
f |
[FE]D:301 |
x,y,z |
1_555 |
1 |
1 |
137 |
43.4 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.030 |
38 |
|
[AKG]F:301 |
4 |
1 |
287 |
f |
[FE]F:300 |
x,y,z |
1_555 |
1 |
1 |
137 |
43.4 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.030 |
39 |
|
[AKG]C:301 |
4 |
1 |
286 |
f |
[FE]C:300 |
x,y,z |
1_555 |
1 |
1 |
137 |
43.2 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.030 |
40 |
|
[AKG]A:301 |
4 |
1 |
285 |
f |
[FE]A:300 |
x,y,z |
1_555 |
1 |
1 |
137 |
42.8 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.030 |
Average: |
43.4 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.030 |
22 |
41 |
|
C |
6 |
4 |
12073 |
f |
[MG]D:304 |
x,y-1,z |
1_545 |
1 |
1 |
98 |
37.8 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.018 |
42 |
|
[MG]D:303 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
6 |
4 |
11801 |
36.1 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.018 |
43 |
|
A |
7 |
4 |
11874 |
f |
[MG]B:303 |
x,y-1,z |
1_545 |
1 |
1 |
98 |
33.1 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.018 |
Average: |
35.7 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.018 |
23 |
44 |
|
F |
6 |
4 |
12064 |
x |
F |
x-1/2,-y-1/2,-z |
4_445 |
5 |
2 |
12064 |
37.4 |
0.6 |
0.756 |
0 |
0 |
0 |
0.000 |
24 |
45 |
|
F |
5 |
2 |
12064 |
◊ |
[MG]D:303 |
x,y-1,z |
1_545 |
1 |
1 |
98 |
29.4 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.000 |
46 |
|
E |
5 |
2 |
12005 |
◊ |
[MG]B:303 |
x,y-1,z |
1_545 |
1 |
1 |
98 |
28.8 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.000 |
47 |
|
[MG]D:304 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
11801 |
28.4 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.000 |
48 |
|
[MG]B:303 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
12201 |
27.1 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.000 |
49 |
|
C |
5 |
2 |
12073 |
◊ |
[MG]D:303 |
x,y-1,z |
1_545 |
1 |
1 |
98 |
25.5 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
27.8 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.000 |
25 |
50 |
|
E |
2 |
1 |
12005 |
◊ |
D |
x,y-1,z |
1_545 |
3 |
2 |
11801 |
5.6 |
0.1 |
0.691 |
0 |
0 |
0 |
0.000 |
51 |
|
F |
1 |
1 |
12064 |
◊ |
E |
x-1,y,z |
1_455 |
1 |
1 |
12005 |
2.6 |
0.1 |
0.769 |
0 |
0 |
0 |
0.000 |
Average: |
4.1 |
0.1 |
0.730 |
0 |
0 |
0 |
0.000 |
26 |
52 |
|
F |
1 |
1 |
12064 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
11874 |
2.3 |
0.0 |
0.573 |
0 |
0 |
0 |
0.000 |
27 |
53 |
|
A |
1 |
1 |
11874 |
◊ |
D |
x,y-1,z |
1_545 |
2 |
1 |
11801 |
1.5 |
-0.0 |
0.518 |
0 |
0 |
0 |
0.000 |
|