## |
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 |
226 |
54 |
22858 |
◊ |
B |
x,y,z |
1_555 |
221 |
51 |
22488 |
2102.6 |
-34.2 |
0.003 |
18 |
0 |
0 |
0.377 |
2 |
|
D |
220 |
50 |
22561 |
◊ |
A |
x,y,z |
1_555 |
220 |
52 |
22098 |
2098.9 |
-31.2 |
0.006 |
21 |
0 |
0 |
0.377 |
Average: |
2100.7 |
-32.7 |
0.004 |
20 |
0 |
0 |
0.377 |
2 |
3 |
|
B |
84 |
25 |
22488 |
◊ |
A |
x,y,z |
1_555 |
87 |
27 |
22098 |
799.5 |
-4.3 |
0.443 |
4 |
0 |
0 |
0.000 |
3 |
4 |
|
[HEM]B:600 |
43 |
1 |
835 |
f |
B |
x,y,z |
1_555 |
86 |
33 |
22488 |
583.8 |
-21.4 |
0.383 |
6 |
0 |
0 |
0.419 |
5 |
|
[HEM]A:600 |
43 |
1 |
831 |
f |
A |
x,y,z |
1_555 |
85 |
35 |
22098 |
583.4 |
-20.5 |
0.446 |
6 |
0 |
0 |
0.419 |
6 |
|
[HEM]D:600 |
43 |
1 |
833 |
f |
D |
x,y,z |
1_555 |
88 |
34 |
22561 |
580.8 |
-19.3 |
0.559 |
6 |
0 |
0 |
0.419 |
7 |
|
[HEM]C:600 |
43 |
1 |
825 |
f |
C |
x,y,z |
1_555 |
86 |
35 |
22858 |
574.1 |
-19.8 |
0.511 |
6 |
0 |
0 |
0.419 |
Average: |
580.5 |
-20.3 |
0.475 |
6 |
0 |
0 |
0.419 |
4 |
8 |
|
D |
60 |
18 |
22561 |
◊ |
C |
-x-1/2,-y+2,z-1/2 |
2_474 |
52 |
16 |
22858 |
526.8 |
-0.4 |
0.663 |
1 |
4 |
0 |
0.000 |
5 |
9 |
|
D |
49 |
14 |
22561 |
◊ |
C |
-x,y-1/2,-z+1/2 |
3_545 |
47 |
14 |
22858 |
429.4 |
-4.9 |
0.224 |
6 |
0 |
0 |
0.000 |
6 |
10 |
|
[3NX]C:601 |
27 |
1 |
570 |
f |
C |
x,y,z |
1_555 |
57 |
23 |
22858 |
395.7 |
-8.1 |
0.288 |
2 |
0 |
0 |
0.159 |
11 |
|
[3NX]A:601 |
27 |
1 |
572 |
f |
A |
x,y,z |
1_555 |
49 |
22 |
22098 |
389.6 |
-8.2 |
0.202 |
2 |
0 |
0 |
0.159 |
12 |
|
[3NX]B:601 |
26 |
1 |
570 |
f |
B |
x,y,z |
1_555 |
47 |
22 |
22488 |
385.9 |
-8.1 |
0.206 |
2 |
0 |
0 |
0.159 |
13 |
|
[3NX]D:601 |
27 |
1 |
569 |
f |
D |
x,y,z |
1_555 |
51 |
22 |
22561 |
380.8 |
-6.6 |
0.432 |
2 |
0 |
0 |
0.159 |
Average: |
388.0 |
-7.8 |
0.282 |
2 |
0 |
0 |
0.159 |
7 |
14 |
|
D |
32 |
14 |
22561 |
◊ |
B |
x,y,z |
1_555 |
31 |
10 |
22488 |
293.8 |
0.0 |
0.662 |
2 |
3 |
0 |
0.000 |
15 |
|
C |
33 |
13 |
22858 |
◊ |
A |
x,y,z |
1_555 |
31 |
9 |
22098 |
277.5 |
-0.6 |
0.533 |
2 |
2 |
0 |
0.000 |
Average: |
285.6 |
-0.3 |
0.597 |
2 |
3 |
0 |
0.000 |
8 |
16 |
|
A |
36 |
11 |
22098 |
◊ |
C |
-x,y-1/2,-z+1/2 |
3_545 |
29 |
8 |
22858 |
268.1 |
-2.0 |
0.408 |
0 |
1 |
0 |
0.000 |
17 |
|
D |
31 |
8 |
22561 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
33 |
11 |
22488 |
259.0 |
-2.5 |
0.358 |
0 |
2 |
0 |
0.000 |
Average: |
263.6 |
-2.2 |
0.383 |
0 |
2 |
0 |
0.000 |
9 |
18 |
|
D |
19 |
11 |
22561 |
◊ |
C |
x,y,z |
1_555 |
24 |
13 |
22858 |
215.6 |
2.3 |
0.809 |
0 |
1 |
0 |
0.000 |
10 |
19 |
|
C |
22 |
10 |
22858 |
◊ |
A |
x-1,y,z |
1_455 |
22 |
6 |
22098 |
180.0 |
2.8 |
0.890 |
1 |
1 |
0 |
0.000 |
11 |
20 |
|
A |
19 |
9 |
22098 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
19 |
8 |
22488 |
158.0 |
-1.3 |
0.416 |
0 |
0 |
0 |
0.000 |
12 |
21 |
|
C |
15 |
4 |
22858 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
15 |
6 |
22488 |
137.5 |
1.1 |
0.591 |
2 |
0 |
0 |
0.000 |
22 |
|
A |
16 |
7 |
22098 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
11 |
4 |
22561 |
125.4 |
0.6 |
0.563 |
0 |
0 |
0 |
0.000 |
Average: |
131.4 |
0.8 |
0.577 |
1 |
0 |
0 |
0.000 |
13 |
23 |
|
C |
10 |
4 |
22858 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
13 |
3 |
22561 |
97.6 |
0.0 |
0.496 |
0 |
0 |
0 |
0.000 |
14 |
24 |
|
[3NX]D:601 |
8 |
1 |
569 |
f |
[HEM]D:600 |
x,y,z |
1_555 |
25 |
1 |
833 |
82.5 |
-2.2 |
0.844 |
0 |
0 |
0 |
0.055 |
25 |
|
[3NX]C:601 |
8 |
1 |
570 |
f |
[HEM]C:600 |
x,y,z |
1_555 |
25 |
1 |
825 |
82.3 |
-3.0 |
0.697 |
0 |
0 |
0 |
0.055 |
26 |
|
[3NX]B:601 |
8 |
1 |
570 |
f |
[HEM]B:600 |
x,y,z |
1_555 |
25 |
1 |
835 |
81.9 |
-3.2 |
0.709 |
0 |
0 |
0 |
0.055 |
27 |
|
[3NX]A:601 |
8 |
1 |
572 |
f |
[HEM]A:600 |
x,y,z |
1_555 |
25 |
1 |
831 |
81.8 |
-3.1 |
0.696 |
0 |
0 |
0 |
0.055 |
Average: |
82.1 |
-2.9 |
0.736 |
0 |
0 |
0 |
0.055 |
15 |
28 |
|
C |
4 |
2 |
22858 |
◊ |
B |
x-1,y,z |
1_455 |
6 |
3 |
22488 |
43.8 |
1.7 |
0.915 |
0 |
0 |
0 |
0.000 |
16 |
29 |
|
A |
1 |
1 |
22098 |
◊ |
C |
-x-1/2,-y+2,z-1/2 |
2_474 |
4 |
1 |
22858 |
31.0 |
-0.8 |
0.119 |
0 |
0 |
0 |
0.000 |
17 |
30 |
|
D |
2 |
1 |
22561 |
◊ |
A |
-x+1/2,-y+2,z-1/2 |
2_574 |
4 |
2 |
22098 |
26.3 |
0.2 |
0.701 |
0 |
0 |
0 |
0.000 |
18 |
31 |
|
C |
2 |
1 |
22858 |
◊ |
B |
x-1/2,-y+5/2,-z+1 |
4_476 |
2 |
1 |
22488 |
12.8 |
-0.0 |
0.539 |
0 |
0 |
0 |
0.000 |
19 |
32 |
|
A |
3 |
1 |
22098 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
22488 |
6.8 |
0.3 |
0.799 |
0 |
0 |
0 |
0.000 |
|