## |
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 |
123 |
33 |
13778 |
◊ |
B |
x,y,z |
1_555 |
126 |
33 |
13917 |
1260.5 |
-19.3 |
0.038 |
12 |
4 |
0 |
0.373 |
2 |
|
F |
118 |
32 |
13881 |
◊ |
D |
x,y,z |
1_555 |
120 |
32 |
13953 |
1181.6 |
-20.3 |
0.014 |
13 |
0 |
0 |
0.373 |
3 |
|
C |
118 |
31 |
13955 |
◊ |
A |
x,y,z |
1_555 |
116 |
31 |
13896 |
1170.8 |
-16.4 |
0.059 |
13 |
5 |
0 |
0.373 |
Average: |
1204.3 |
-18.7 |
0.037 |
13 |
3 |
0 |
0.373 |
2 |
4 |
|
A |
79 |
22 |
13896 |
◊ |
E |
-x,y-1/2,-z+1/2 |
3_545 |
81 |
26 |
13778 |
667.2 |
-2.6 |
0.683 |
7 |
6 |
0 |
0.000 |
3 |
5 |
|
[HEM]E:401 |
43 |
1 |
800 |
f |
E |
x,y,z |
1_555 |
86 |
31 |
13778 |
585.7 |
-21.4 |
0.419 |
4 |
0 |
0 |
0.656 |
6 |
|
[HEM]B:401 |
43 |
1 |
794 |
f |
B |
x,y,z |
1_555 |
82 |
31 |
13917 |
582.8 |
-20.2 |
0.484 |
5 |
0 |
0 |
0.656 |
7 |
|
[HEM]A:401 |
43 |
1 |
797 |
f |
A |
x,y,z |
1_555 |
82 |
31 |
13896 |
581.8 |
-21.1 |
0.385 |
4 |
0 |
0 |
0.656 |
8 |
|
[HEM]F:401 |
43 |
1 |
798 |
f |
F |
x,y,z |
1_555 |
79 |
30 |
13881 |
581.7 |
-20.1 |
0.485 |
5 |
0 |
0 |
0.656 |
9 |
|
[HEM]D:401 |
43 |
1 |
797 |
f |
D |
x,y,z |
1_555 |
82 |
30 |
13953 |
580.6 |
-20.2 |
0.464 |
6 |
0 |
0 |
0.656 |
10 |
|
[HEM]C:401 |
43 |
1 |
791 |
f |
C |
x,y,z |
1_555 |
83 |
31 |
13955 |
578.6 |
-20.0 |
0.492 |
5 |
0 |
0 |
0.656 |
Average: |
581.9 |
-20.5 |
0.455 |
5 |
0 |
0 |
0.656 |
4 |
11 |
|
D |
66 |
24 |
13953 |
◊ |
C |
x,y,z |
1_555 |
55 |
13 |
13955 |
554.4 |
-5.6 |
0.304 |
4 |
4 |
0 |
0.163 |
12 |
|
D |
54 |
13 |
13953 |
◊ |
B |
x,y,z |
1_555 |
66 |
24 |
13917 |
546.5 |
-5.0 |
0.364 |
3 |
4 |
0 |
0.163 |
13 |
|
F |
62 |
23 |
13881 |
◊ |
E |
x,y,z |
1_555 |
53 |
12 |
13778 |
521.3 |
-5.3 |
0.353 |
3 |
4 |
0 |
0.163 |
14 |
|
F |
52 |
11 |
13881 |
◊ |
A |
x,y,z |
1_555 |
60 |
20 |
13896 |
513.5 |
-5.0 |
0.319 |
4 |
5 |
0 |
0.163 |
15 |
|
C |
55 |
20 |
13955 |
◊ |
B |
x,y,z |
1_555 |
49 |
11 |
13917 |
503.1 |
-5.2 |
0.278 |
5 |
5 |
0 |
0.163 |
16 |
|
E |
63 |
21 |
13778 |
◊ |
A |
x,y,z |
1_555 |
50 |
11 |
13896 |
498.0 |
-6.6 |
0.237 |
3 |
4 |
0 |
0.163 |
Average: |
522.8 |
-5.4 |
0.309 |
4 |
4 |
0 |
0.163 |
5 |
17 |
|
F |
36 |
13 |
13881 |
◊ |
B |
x,y,z |
1_555 |
35 |
11 |
13917 |
322.5 |
-7.8 |
0.045 |
1 |
0 |
0 |
0.083 |
18 |
|
D |
33 |
12 |
13953 |
◊ |
A |
x,y,z |
1_555 |
32 |
11 |
13896 |
319.9 |
-7.1 |
0.050 |
2 |
0 |
0 |
0.083 |
19 |
|
E |
31 |
12 |
13778 |
◊ |
C |
x,y,z |
1_555 |
29 |
10 |
13955 |
282.4 |
-7.0 |
0.049 |
1 |
0 |
0 |
0.083 |
Average: |
308.3 |
-7.3 |
0.048 |
1 |
0 |
0 |
0.083 |
6 |
20 |
|
D |
30 |
11 |
13953 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
39 |
15 |
13896 |
308.0 |
-3.0 |
0.309 |
0 |
0 |
0 |
0.002 |
7 |
21 |
|
F |
36 |
9 |
13881 |
◊ |
B |
-x-1,y-1/2,-z+1/2 |
3_445 |
31 |
13 |
13917 |
285.8 |
-0.5 |
0.654 |
3 |
0 |
0 |
0.000 |
8 |
22 |
|
[PG4]D:402 |
12 |
1 |
412 |
◊ |
D |
x,y,z |
1_555 |
27 |
9 |
13953 |
170.3 |
3.3 |
0.290 |
2 |
0 |
0 |
0.000 |
9 |
23 |
|
D |
14 |
5 |
13953 |
◊ |
E |
x-1,y,z |
1_455 |
19 |
6 |
13778 |
153.8 |
-0.5 |
0.596 |
2 |
0 |
0 |
0.000 |
10 |
24 |
|
B |
19 |
8 |
13917 |
◊ |
C |
x-1/2,-y+1/2,-z |
4_455 |
16 |
5 |
13955 |
138.7 |
-0.1 |
0.537 |
0 |
0 |
0 |
0.000 |
11 |
25 |
|
F |
12 |
7 |
13881 |
x |
F |
-x-1,y-1/2,-z+1/2 |
3_445 |
10 |
5 |
13881 |
109.9 |
1.1 |
0.833 |
2 |
4 |
0 |
0.000 |
12 |
26 |
|
D |
19 |
5 |
13953 |
◊ |
C |
x-1,y,z |
1_455 |
15 |
6 |
13955 |
106.8 |
-0.7 |
0.569 |
2 |
0 |
0 |
0.000 |
13 |
27 |
|
D |
7 |
3 |
13953 |
◊ |
C |
x-1/2,-y-1/2,-z |
4_445 |
12 |
2 |
13955 |
92.9 |
-1.6 |
0.166 |
0 |
0 |
0 |
0.001 |
14 |
28 |
|
[PG4]D:402 |
2 |
1 |
412 |
f |
C |
x-1,y,z |
1_455 |
6 |
4 |
13955 |
47.4 |
1.8 |
0.554 |
1 |
0 |
0 |
0.000 |
15 |
29 |
|
[O]A:403 |
1 |
1 |
99 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
13896 |
41.8 |
1.2 |
0.939 |
0 |
0 |
0 |
0.000 |
30 |
|
[O]C:403 |
1 |
1 |
99 |
f |
C |
x,y,z |
1_555 |
9 |
5 |
13955 |
41.2 |
1.2 |
0.934 |
0 |
0 |
0 |
0.000 |
31 |
|
[O]B:402 |
1 |
1 |
99 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
13917 |
41.1 |
1.2 |
0.940 |
0 |
0 |
0 |
0.000 |
32 |
|
[O]F:402 |
1 |
1 |
99 |
f |
F |
x,y,z |
1_555 |
9 |
5 |
13881 |
40.8 |
1.2 |
0.939 |
0 |
0 |
0 |
0.000 |
33 |
|
[O]D:403 |
1 |
1 |
99 |
f |
D |
x,y,z |
1_555 |
8 |
5 |
13953 |
40.3 |
1.1 |
0.930 |
0 |
0 |
0 |
0.000 |
34 |
|
[O]E:402 |
1 |
1 |
99 |
f |
E |
x,y,z |
1_555 |
7 |
5 |
13778 |
40.0 |
1.0 |
0.927 |
0 |
0 |
0 |
0.000 |
Average: |
40.9 |
1.2 |
0.935 |
0 |
0 |
0 |
0.000 |
16 |
35 |
|
[MG]A:402 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
13896 |
40.3 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.061 |
17 |
36 |
|
D |
7 |
5 |
13953 |
◊ |
[MG]A:402 |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
98 |
36.9 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.003 |
18 |
37 |
|
[MG]C:402 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
13955 |
34.4 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.050 |
19 |
38 |
|
[O]E:402 |
1 |
1 |
99 |
cf |
[HEM]E:401 |
x,y,z |
1_555 |
16 |
1 |
800 |
33.2 |
-0.5 |
1.000 |
0 |
0 |
0 |
0.015 |
39 |
|
[O]D:403 |
1 |
1 |
99 |
cf |
[HEM]D:401 |
x,y,z |
1_555 |
17 |
1 |
797 |
33.1 |
-0.5 |
1.000 |
0 |
0 |
0 |
0.015 |
40 |
|
[O]C:403 |
1 |
1 |
99 |
cf |
[HEM]C:401 |
x,y,z |
1_555 |
16 |
1 |
791 |
32.7 |
-0.5 |
1.000 |
0 |
0 |
0 |
0.015 |
41 |
|
[O]F:402 |
1 |
1 |
99 |
cf |
[HEM]F:401 |
x,y,z |
1_555 |
16 |
1 |
798 |
32.6 |
-0.5 |
1.000 |
0 |
0 |
0 |
0.015 |
42 |
|
[O]A:403 |
1 |
1 |
99 |
cf |
[HEM]A:401 |
x,y,z |
1_555 |
16 |
1 |
797 |
32.4 |
-0.4 |
1.000 |
0 |
0 |
0 |
0.015 |
43 |
|
[O]B:402 |
1 |
1 |
99 |
cf |
[HEM]B:401 |
x,y,z |
1_555 |
16 |
1 |
794 |
32.1 |
-0.4 |
1.000 |
0 |
0 |
0 |
0.015 |
Average: |
32.7 |
-0.5 |
1.000 |
0 |
0 |
0 |
0.015 |
20 |
44 |
|
D |
7 |
4 |
13953 |
◊ |
[MG]C:402 |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
98 |
29.2 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.002 |
21 |
45 |
|
[MG]A:402 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
13955 |
13.2 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.013 |
22 |
46 |
|
D |
1 |
1 |
13953 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
13917 |
0.6 |
0.0 |
0.673 |
0 |
0 |
0 |
0.000 |
|