## |
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 |
271 |
70 |
19852 |
◊ |
A |
x,y,z |
1_555 |
260 |
70 |
19644 |
2614.4 |
-39.1 |
0.005 |
35 |
9 |
0 |
0.597 |
2 |
2 |
|
A |
67 |
20 |
19644 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
69 |
19 |
19852 |
651.5 |
-0.7 |
0.715 |
16 |
0 |
0 |
0.000 |
3 |
3 |
|
[HEM]A:750 |
43 |
1 |
817 |
f |
A |
x,y,z |
1_555 |
78 |
24 |
19644 |
512.4 |
-17.9 |
0.315 |
1 |
0 |
0 |
0.392 |
4 |
|
[HEM]B:750 |
43 |
1 |
813 |
f |
B |
x,y,z |
1_555 |
77 |
24 |
19852 |
512.2 |
-18.0 |
0.286 |
1 |
0 |
0 |
0.392 |
Average: |
512.3 |
-17.9 |
0.300 |
1 |
0 |
0 |
0.392 |
4 |
5 |
|
B |
50 |
16 |
19852 |
x |
B |
x-1,y,z |
1_455 |
52 |
15 |
19852 |
462.7 |
-1.6 |
0.555 |
3 |
0 |
0 |
0.000 |
5 |
6 |
|
B |
40 |
12 |
19852 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
37 |
11 |
19644 |
346.3 |
-2.2 |
0.484 |
3 |
2 |
0 |
0.000 |
6 |
7 |
|
[JI1]A:800 |
16 |
1 |
467 |
f |
A |
x,y,z |
1_555 |
37 |
16 |
19644 |
247.6 |
5.3 |
0.243 |
3 |
0 |
0 |
0.000 |
8 |
|
[JI1]B:800 |
17 |
1 |
470 |
f |
B |
x,y,z |
1_555 |
38 |
15 |
19852 |
241.9 |
5.3 |
0.183 |
3 |
0 |
0 |
0.000 |
Average: |
244.8 |
5.3 |
0.213 |
3 |
0 |
0 |
0.000 |
7 |
9 |
|
A |
32 |
12 |
19644 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
23 |
10 |
19852 |
202.7 |
1.4 |
0.782 |
0 |
2 |
0 |
0.000 |
8 |
10 |
|
[H4B]B:760 |
17 |
1 |
399 |
f |
B |
x,y,z |
1_555 |
29 |
8 |
19852 |
199.8 |
2.0 |
0.449 |
2 |
0 |
0 |
0.000 |
11 |
|
[H4B]A:760 |
17 |
1 |
401 |
f |
A |
x,y,z |
1_555 |
27 |
9 |
19644 |
193.1 |
1.9 |
0.462 |
2 |
0 |
0 |
0.000 |
Average: |
196.5 |
1.9 |
0.455 |
2 |
0 |
0 |
0.000 |
9 |
12 |
|
[JI1]B:800 |
14 |
1 |
470 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
32 |
1 |
813 |
145.0 |
0.7 |
0.216 |
1 |
0 |
0 |
0.000 |
13 |
|
[JI1]A:800 |
14 |
1 |
467 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
33 |
1 |
817 |
142.6 |
0.5 |
0.226 |
1 |
0 |
0 |
0.000 |
Average: |
143.8 |
0.6 |
0.221 |
1 |
0 |
0 |
0.000 |
10 |
14 |
|
[H4B]A:760 |
14 |
1 |
401 |
◊ |
B |
x,y,z |
1_555 |
22 |
6 |
19852 |
116.8 |
-0.0 |
0.266 |
1 |
0 |
0 |
0.011 |
15 |
|
[H4B]B:760 |
13 |
1 |
399 |
◊ |
A |
x,y,z |
1_555 |
22 |
6 |
19644 |
116.3 |
-0.1 |
0.262 |
1 |
0 |
0 |
0.011 |
Average: |
116.5 |
-0.1 |
0.264 |
1 |
0 |
0 |
0.011 |
11 |
16 |
|
[ACT]B:860 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
17 |
7 |
19852 |
111.6 |
-1.3 |
0.471 |
1 |
0 |
0 |
0.019 |
12 |
17 |
|
[ACT]A:860 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
19644 |
110.2 |
-1.2 |
0.513 |
1 |
0 |
0 |
0.017 |
13 |
18 |
|
[H4B]B:760 |
4 |
1 |
399 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
813 |
41.7 |
-1.2 |
0.447 |
2 |
0 |
0 |
0.045 |
19 |
|
[H4B]A:760 |
4 |
1 |
401 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
817 |
41.2 |
-1.2 |
0.454 |
2 |
0 |
0 |
0.045 |
Average: |
41.5 |
-1.2 |
0.450 |
2 |
0 |
0 |
0.045 |
14 |
20 |
|
[ACT]B:860 |
3 |
1 |
183 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
813 |
37.3 |
-1.1 |
0.750 |
0 |
0 |
0 |
0.012 |
15 |
21 |
|
[ACT]A:860 |
3 |
1 |
183 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
817 |
36.4 |
-1.1 |
0.749 |
0 |
0 |
0 |
0.011 |
16 |
22 |
|
[ZN]A:900 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
19852 |
34.8 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.302 |
23 |
|
[ZN]A:900 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
19644 |
34.3 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.302 |
Average: |
34.5 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.302 |
17 |
24 |
|
B |
2 |
1 |
19852 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
5 |
3 |
19852 |
27.6 |
1.2 |
0.895 |
0 |
0 |
0 |
0.000 |
18 |
25 |
|
[JI1]B:800 |
2 |
1 |
470 |
f |
[H4B]B:760 |
x,y,z |
1_555 |
3 |
1 |
399 |
19.9 |
-0.4 |
0.088 |
0 |
0 |
0 |
0.007 |
26 |
|
[JI1]A:800 |
2 |
1 |
467 |
f |
[H4B]A:760 |
x,y,z |
1_555 |
3 |
1 |
401 |
18.2 |
-0.3 |
0.099 |
0 |
0 |
0 |
0.007 |
Average: |
19.1 |
-0.4 |
0.094 |
0 |
0 |
0 |
0.007 |
19 |
27 |
|
A |
2 |
1 |
19644 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
19644 |
16.2 |
-0.5 |
0.191 |
0 |
0 |
0 |
0.000 |
|