| ## |
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 |
|
C |
118 |
30 |
14002 |
◊ |
C |
x-y,-y,-z+1/3 |
5_555 |
118 |
30 |
14002 |
1183.4 |
-14.5 |
0.088 |
10 |
0 |
0 |
0.181 |
2 |
|
B |
126 |
32 |
13976 |
◊ |
A |
x,y,z |
1_555 |
122 |
33 |
14064 |
1177.4 |
-15.0 |
0.109 |
14 |
0 |
0 |
0.181 |
| Average: |
1180.4 |
-14.7 |
0.099 |
12 |
0 |
0 |
0.181 |
| 2 |
3 |
|
C |
76 |
24 |
14002 |
◊ |
A |
x,y,z |
1_555 |
70 |
16 |
14064 |
743.4 |
-3.9 |
0.505 |
9 |
6 |
0 |
0.119 |
4 |
|
B |
67 |
16 |
13976 |
◊ |
A |
x-y,-y,-z+1/3 |
5_555 |
74 |
24 |
14064 |
733.5 |
-2.8 |
0.601 |
9 |
5 |
0 |
0.119 |
5 |
|
C |
68 |
18 |
14002 |
◊ |
B |
x-y,-y,-z+1/3 |
5_555 |
73 |
24 |
13976 |
726.9 |
-3.7 |
0.547 |
9 |
2 |
0 |
0.119 |
| Average: |
734.6 |
-3.5 |
0.551 |
9 |
4 |
0 |
0.119 |
| 3 |
6 |
|
[HEM]C:401 |
43 |
1 |
816 |
f |
C |
x,y,z |
1_555 |
78 |
32 |
14002 |
611.8 |
-20.5 |
0.481 |
4 |
0 |
0 |
0.393 |
7 |
|
[HEM]A:401 |
43 |
1 |
810 |
cf |
A |
x,y,z |
1_555 |
78 |
32 |
14064 |
605.3 |
-20.5 |
0.464 |
3 |
0 |
0 |
0.393 |
8 |
|
[HEM]B:401 |
43 |
1 |
812 |
f |
B |
x,y,z |
1_555 |
81 |
32 |
13976 |
604.3 |
-20.7 |
0.491 |
3 |
0 |
0 |
0.393 |
| Average: |
607.1 |
-20.5 |
0.478 |
3 |
0 |
0 |
0.393 |
| 4 |
9 |
|
A |
60 |
20 |
14064 |
◊ |
B |
y-1,x,-z |
4_455 |
60 |
19 |
13976 |
560.7 |
-4.1 |
0.449 |
4 |
2 |
0 |
0.000 |
| 5 |
10 |
|
A |
39 |
13 |
14064 |
◊ |
A |
x-y,-y,-z+1/3 |
5_555 |
39 |
13 |
14064 |
342.1 |
-3.0 |
0.414 |
4 |
0 |
0 |
0.027 |
11 |
|
C |
39 |
11 |
14002 |
◊ |
B |
x,y,z |
1_555 |
36 |
11 |
13976 |
332.1 |
-1.1 |
0.632 |
4 |
1 |
0 |
0.027 |
| Average: |
337.1 |
-2.1 |
0.523 |
4 |
1 |
0 |
0.027 |
| 6 |
12 |
|
C |
14 |
10 |
14002 |
◊ |
C |
y,x,-z |
4_555 |
14 |
10 |
14002 |
93.4 |
1.2 |
0.831 |
1 |
0 |
0 |
0.000 |
| 7 |
13 |
|
[GOL]A:404 |
4 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
14064 |
75.4 |
-0.7 |
0.481 |
1 |
0 |
0 |
0.009 |
| 8 |
14 |
|
[GOL]A:404 |
5 |
1 |
217 |
◊ |
B |
x,y,z |
1_555 |
11 |
6 |
13976 |
70.8 |
-0.6 |
0.504 |
1 |
0 |
0 |
0.009 |
| 9 |
15 |
|
[CL]B:402 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
13976 |
69.1 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.206 |
16 |
|
[CL]C:402 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
14 |
6 |
14002 |
68.6 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.206 |
17 |
|
[CL]A:402 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
14064 |
67.8 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.206 |
| Average: |
68.5 |
-11.7 |
0.000 |
0 |
0 |
0 |
0.206 |
| 10 |
18 |
|
[CL]C:403 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
8 |
5 |
14002 |
57.3 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.103 |
19 |
|
[CL]B:403 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
13976 |
56.5 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.103 |
20 |
|
[CL]A:403 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
14064 |
56.4 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.103 |
| Average: |
56.7 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.103 |
| 11 |
21 |
|
[CL]B:403 |
1 |
1 |
125 |
f |
[HEM]B:401 |
x,y,z |
1_555 |
16 |
1 |
812 |
44.1 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.114 |
22 |
|
[CL]C:403 |
1 |
1 |
125 |
f |
[HEM]C:401 |
x,y,z |
1_555 |
16 |
1 |
816 |
43.9 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.114 |
23 |
|
[CL]A:403 |
1 |
1 |
125 |
f |
[HEM]A:401 |
x,y,z |
1_555 |
17 |
1 |
810 |
43.4 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.114 |
| Average: |
43.8 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.114 |
| 12 |
24 |
|
[CL]C:402 |
1 |
1 |
125 |
◊ |
C |
x-y,-y,-z+1/3 |
5_555 |
3 |
2 |
14002 |
7.9 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.016 |
25 |
|
[CL]A:402 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
13976 |
7.2 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.016 |
26 |
|
[CL]B:402 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
14064 |
6.6 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.016 |
| Average: |
7.2 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.016 |
|