## |
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 |
361 |
97 |
29078 |
◊ |
A |
x,y,z |
1_555 |
364 |
98 |
29313 |
3445.1 |
-36.1 |
0.045 |
41 |
4 |
0 |
0.274 |
2 |
2 |
|
[HEM]A:801 |
43 |
1 |
821 |
f |
A |
x,y,z |
1_555 |
87 |
31 |
29313 |
604.1 |
-21.4 |
0.495 |
5 |
0 |
0 |
0.230 |
3 |
|
[HEM]B:801 |
43 |
1 |
818 |
f |
B |
x,y,z |
1_555 |
88 |
31 |
29078 |
603.5 |
-20.4 |
0.560 |
5 |
0 |
0 |
0.230 |
Average: |
603.8 |
-20.9 |
0.527 |
5 |
0 |
0 |
0.230 |
3 |
4 |
|
A |
41 |
13 |
29313 |
◊ |
B |
-x-1/2,-y-1,z-1/2 |
2_444 |
49 |
15 |
29078 |
373.2 |
-1.7 |
0.581 |
3 |
4 |
0 |
0.000 |
4 |
5 |
|
B |
38 |
15 |
29078 |
x |
B |
x-1/2,-y-1/2,-z |
4_445 |
49 |
21 |
29078 |
350.7 |
-4.2 |
0.281 |
4 |
4 |
0 |
0.000 |
5 |
6 |
|
A |
32 |
12 |
29313 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
31 |
12 |
29078 |
322.9 |
2.0 |
0.851 |
3 |
3 |
0 |
0.000 |
6 |
7 |
|
[MPD]A:807 |
7 |
1 |
269 |
f |
A |
x,y,z |
1_555 |
22 |
11 |
29313 |
170.2 |
-10.4 |
0.571 |
1 |
0 |
0 |
0.054 |
7 |
8 |
|
[MPD]B:807 |
7 |
1 |
265 |
f |
B |
x,y,z |
1_555 |
20 |
10 |
29078 |
163.4 |
-10.4 |
0.541 |
2 |
0 |
0 |
0.056 |
8 |
9 |
|
A |
17 |
6 |
29313 |
◊ |
B |
-x,y-1/2,-z-1/2 |
3_544 |
14 |
5 |
29078 |
153.0 |
-0.2 |
0.638 |
3 |
3 |
0 |
0.000 |
9 |
10 |
|
[MPD]B:806 |
7 |
1 |
280 |
f |
B |
x,y,z |
1_555 |
17 |
6 |
29078 |
106.8 |
-5.5 |
0.856 |
1 |
0 |
0 |
0.030 |
10 |
11 |
|
[PO4]B:805 |
5 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
29078 |
92.1 |
-3.2 |
0.962 |
5 |
0 |
0 |
0.027 |
11 |
12 |
|
[MPD]A:806 |
6 |
1 |
281 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
29313 |
88.6 |
-4.5 |
0.866 |
3 |
0 |
0 |
0.029 |
12 |
13 |
|
[PO4]A:805 |
5 |
1 |
190 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
29313 |
87.8 |
-3.1 |
0.961 |
5 |
0 |
0 |
0.027 |
13 |
14 |
|
[MPD]A:808 |
6 |
1 |
271 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
29313 |
87.2 |
-5.7 |
0.663 |
0 |
0 |
0 |
0.028 |
14 |
15 |
|
[CL]B:803 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
17 |
7 |
29078 |
80.5 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.114 |
16 |
|
[CL]A:803 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
29313 |
79.5 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.114 |
Average: |
80.0 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.114 |
15 |
17 |
|
A |
7 |
3 |
29313 |
◊ |
[MPD]B:806 |
x-1/2,-y-1/2,-z |
4_445 |
5 |
1 |
280 |
72.3 |
-4.7 |
0.327 |
0 |
0 |
0 |
0.000 |
16 |
18 |
|
[NA]B:802 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
29078 |
67.0 |
-11.0 |
0.000 |
0 |
0 |
0 |
0.109 |
19 |
|
[NA]A:802 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
29313 |
65.8 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.109 |
Average: |
66.4 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.109 |
17 |
20 |
|
[OXY]B:804 |
2 |
1 |
121 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
29078 |
57.8 |
1.9 |
0.967 |
2 |
0 |
0 |
0.000 |
18 |
21 |
|
[OXY]A:804 |
2 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
29313 |
57.3 |
1.9 |
0.963 |
2 |
0 |
0 |
0.000 |
19 |
22 |
|
[OXY]A:804 |
2 |
1 |
123 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
10 |
1 |
821 |
39.7 |
-0.2 |
1.000 |
0 |
0 |
0 |
0.001 |
20 |
23 |
|
[OXY]B:804 |
2 |
1 |
121 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
10 |
1 |
818 |
39.2 |
-0.2 |
1.000 |
0 |
0 |
0 |
0.000 |
21 |
24 |
|
[CL]A:803 |
1 |
1 |
125 |
f |
[NA]A:802 |
x,y,z |
1_555 |
1 |
1 |
125 |
15.6 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.015 |
22 |
25 |
|
[CL]B:803 |
1 |
1 |
125 |
f |
[NA]B:802 |
x,y,z |
1_555 |
1 |
1 |
125 |
14.2 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.014 |
|