## |
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 |
|
[FAD]B:2805 |
52 |
1 |
997 |
f |
B |
x,y,z |
1_555 |
105 |
47 |
23065 |
685.2 |
-7.3 |
0.565 |
19 |
0 |
0 |
0.013 |
2 |
|
[FAD]A:1805 |
52 |
1 |
987 |
f |
A |
x,y,z |
1_555 |
102 |
46 |
23166 |
677.8 |
-7.2 |
0.576 |
18 |
0 |
0 |
0.013 |
Average: |
681.5 |
-7.2 |
0.571 |
19 |
0 |
0 |
0.013 |
2 |
3 |
|
[HEM]B:804 |
43 |
1 |
801 |
f |
B |
x,y,z |
1_555 |
85 |
30 |
23065 |
604.2 |
-22.0 |
0.267 |
1 |
0 |
0 |
0.019 |
4 |
|
[HEM]A:804 |
43 |
1 |
801 |
f |
A |
x,y,z |
1_555 |
84 |
30 |
23166 |
602.8 |
-22.1 |
0.255 |
1 |
0 |
0 |
0.019 |
Average: |
603.5 |
-22.0 |
0.261 |
1 |
0 |
0 |
0.019 |
3 |
5 |
|
[HEM]A:803 |
43 |
1 |
836 |
f |
A |
x,y,z |
1_555 |
74 |
27 |
23166 |
560.0 |
-22.1 |
0.182 |
3 |
0 |
0 |
0.020 |
6 |
|
[HEM]B:803 |
42 |
1 |
845 |
f |
B |
x,y,z |
1_555 |
73 |
26 |
23065 |
555.0 |
-21.8 |
0.165 |
2 |
0 |
0 |
0.020 |
Average: |
557.5 |
-22.0 |
0.174 |
3 |
0 |
0 |
0.020 |
4 |
7 |
|
[HEM]B:802 |
41 |
1 |
827 |
f |
B |
x,y,z |
1_555 |
55 |
20 |
23065 |
481.2 |
-18.2 |
0.064 |
1 |
0 |
0 |
0.016 |
8 |
|
[HEM]A:802 |
40 |
1 |
828 |
f |
A |
x,y,z |
1_555 |
57 |
18 |
23166 |
479.7 |
-17.9 |
0.086 |
1 |
0 |
0 |
0.016 |
Average: |
480.4 |
-18.0 |
0.075 |
1 |
0 |
0 |
0.016 |
5 |
9 |
|
[HEM]A:801 |
43 |
1 |
825 |
f |
A |
x,y,z |
1_555 |
60 |
24 |
23166 |
480.4 |
-20.1 |
0.073 |
2 |
0 |
0 |
0.018 |
10 |
|
[HEM]B:801 |
42 |
1 |
826 |
f |
B |
x,y,z |
1_555 |
60 |
23 |
23065 |
474.8 |
-19.8 |
0.067 |
2 |
0 |
0 |
0.018 |
Average: |
477.6 |
-19.9 |
0.070 |
2 |
0 |
0 |
0.018 |
6 |
11 |
|
B |
27 |
10 |
23065 |
◊ |
A |
x,y,z |
1_555 |
34 |
16 |
23166 |
246.9 |
-0.9 |
0.630 |
0 |
0 |
0 |
0.000 |
12 |
|
A |
19 |
6 |
23166 |
◊ |
B |
x,y,z-1 |
1_554 |
21 |
9 |
23065 |
162.0 |
-1.2 |
0.483 |
0 |
0 |
0 |
0.000 |
Average: |
204.4 |
-1.0 |
0.557 |
0 |
0 |
0 |
0.000 |
7 |
13 |
|
A |
13 |
4 |
23166 |
x |
A |
-x+1,y-1/2,-z |
2_645 |
26 |
8 |
23166 |
178.5 |
-0.3 |
0.656 |
4 |
1 |
0 |
0.000 |
14 |
|
B |
12 |
4 |
23065 |
x |
B |
-x+1,y-1/2,-z+1 |
2_646 |
24 |
8 |
23065 |
161.2 |
0.6 |
0.753 |
2 |
1 |
0 |
0.000 |
Average: |
169.8 |
0.2 |
0.705 |
3 |
1 |
0 |
0.000 |
8 |
15 |
|
A |
20 |
6 |
23166 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
15 |
6 |
23065 |
140.5 |
-0.1 |
0.629 |
2 |
1 |
0 |
0.000 |
9 |
16 |
|
A |
15 |
5 |
23166 |
◊ |
[HEM]A:801 |
-x+1,y-1/2,-z |
2_645 |
18 |
1 |
825 |
127.3 |
-3.0 |
0.645 |
0 |
0 |
0 |
0.000 |
17 |
|
B |
15 |
5 |
23065 |
◊ |
[HEM]B:801 |
-x+1,y-1/2,-z+1 |
2_646 |
17 |
1 |
826 |
110.2 |
-2.3 |
0.726 |
0 |
0 |
0 |
0.000 |
Average: |
118.7 |
-2.6 |
0.685 |
0 |
0 |
0 |
0.000 |
10 |
18 |
|
[FUM]A:1806 |
8 |
1 |
253 |
f |
A |
x,y,z |
1_555 |
23 |
15 |
23166 |
120.3 |
2.7 |
0.343 |
9 |
0 |
0 |
0.001 |
19 |
|
[FUM]B:2806 |
8 |
1 |
251 |
f |
B |
x,y,z |
1_555 |
25 |
15 |
23065 |
119.8 |
2.6 |
0.308 |
8 |
0 |
0 |
0.001 |
Average: |
120.0 |
2.6 |
0.325 |
9 |
0 |
0 |
0.001 |
11 |
20 |
|
A |
13 |
4 |
23166 |
x |
A |
x-1,y,z |
1_455 |
15 |
5 |
23166 |
115.3 |
-1.3 |
0.412 |
0 |
0 |
0 |
0.000 |
21 |
|
B |
13 |
3 |
23065 |
x |
B |
x-1,y,z |
1_455 |
12 |
5 |
23065 |
111.6 |
-1.2 |
0.369 |
0 |
0 |
0 |
0.000 |
Average: |
113.5 |
-1.3 |
0.390 |
0 |
0 |
0 |
0.000 |
12 |
22 |
|
B |
16 |
7 |
23065 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
14 |
6 |
23166 |
101.6 |
-0.6 |
0.555 |
0 |
0 |
0 |
0.000 |
13 |
23 |
|
[HEM]B:803 |
17 |
1 |
845 |
f |
[HEM]B:802 |
x,y,z |
1_555 |
18 |
1 |
827 |
91.1 |
-3.1 |
1.000 |
0 |
0 |
0 |
0.003 |
24 |
|
[HEM]A:803 |
17 |
1 |
836 |
f |
[HEM]A:802 |
x,y,z |
1_555 |
17 |
1 |
828 |
90.4 |
-3.0 |
1.000 |
0 |
0 |
0 |
0.003 |
Average: |
90.7 |
-3.0 |
1.000 |
0 |
0 |
0 |
0.003 |
14 |
25 |
|
A |
9 |
4 |
23166 |
x |
A |
-x,y-1/2,-z |
2_545 |
10 |
5 |
23166 |
84.6 |
-0.0 |
0.500 |
2 |
0 |
0 |
0.000 |
26 |
|
B |
8 |
5 |
23065 |
x |
B |
-x,y-1/2,-z+1 |
2_546 |
9 |
4 |
23065 |
64.5 |
-0.3 |
0.503 |
0 |
0 |
0 |
0.000 |
Average: |
74.6 |
-0.1 |
0.502 |
1 |
0 |
0 |
0.000 |
15 |
27 |
|
[NA]B:2810 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
7 |
23065 |
66.3 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.010 |
28 |
|
[NA]A:1810 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
23166 |
66.2 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.010 |
Average: |
66.2 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.010 |
16 |
29 |
|
[FUM]B:2806 |
7 |
1 |
251 |
f |
[FAD]B:2805 |
x,y,z |
1_555 |
14 |
1 |
997 |
64.0 |
2.1 |
0.881 |
0 |
0 |
0 |
0.000 |
30 |
|
[FUM]A:1806 |
7 |
1 |
253 |
f |
[FAD]A:1805 |
x,y,z |
1_555 |
14 |
1 |
987 |
62.2 |
2.0 |
0.877 |
0 |
0 |
0 |
0.000 |
Average: |
63.1 |
2.0 |
0.879 |
0 |
0 |
0 |
0.000 |
17 |
31 |
|
[HEM]B:802 |
10 |
1 |
827 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
4 |
1 |
826 |
62.5 |
-2.1 |
0.852 |
0 |
0 |
0 |
0.002 |
32 |
|
[HEM]A:802 |
11 |
1 |
828 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
4 |
1 |
825 |
62.1 |
-2.0 |
0.860 |
0 |
0 |
0 |
0.002 |
Average: |
62.3 |
-2.1 |
0.856 |
0 |
0 |
0 |
0.002 |
18 |
33 |
|
A |
5 |
2 |
23166 |
◊ |
[HEM]B:802 |
-x+1,y-1/2,-z+1 |
2_646 |
3 |
1 |
827 |
34.8 |
-0.6 |
0.687 |
0 |
0 |
0 |
0.000 |
34 |
|
B |
3 |
2 |
23065 |
◊ |
[HEM]A:802 |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
1 |
828 |
19.5 |
-0.6 |
0.476 |
0 |
0 |
0 |
0.000 |
Average: |
27.2 |
-0.6 |
0.582 |
0 |
0 |
0 |
0.000 |
19 |
35 |
|
[HEM]A:804 |
2 |
1 |
801 |
f |
[HEM]A:803 |
x,y,z |
1_555 |
1 |
1 |
836 |
32.3 |
-1.0 |
0.381 |
0 |
0 |
0 |
0.000 |
36 |
|
[HEM]B:804 |
2 |
1 |
801 |
f |
[HEM]B:803 |
x,y,z |
1_555 |
1 |
1 |
845 |
30.9 |
-1.0 |
0.390 |
0 |
0 |
0 |
0.000 |
Average: |
31.6 |
-1.0 |
0.386 |
0 |
0 |
0 |
0.001 |
20 |
37 |
|
B |
5 |
2 |
23065 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
5 |
3 |
23166 |
22.3 |
0.2 |
0.670 |
0 |
0 |
0 |
0.000 |
21 |
38 |
|
[FAD]A:1805 |
1 |
1 |
987 |
f |
[HEM]A:804 |
x,y,z |
1_555 |
1 |
1 |
801 |
15.6 |
-0.5 |
0.332 |
0 |
0 |
0 |
0.000 |
39 |
|
[FAD]B:2805 |
1 |
1 |
997 |
f |
[HEM]B:804 |
x,y,z |
1_555 |
1 |
1 |
801 |
15.4 |
-0.5 |
0.332 |
0 |
0 |
0 |
0.000 |
Average: |
15.5 |
-0.5 |
0.332 |
0 |
0 |
0 |
0.000 |
22 |
40 |
|
A |
1 |
1 |
23166 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
23065 |
0.6 |
0.0 |
0.676 |
0 |
0 |
0 |
0.000 |
|