## |
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 |
|
D |
109 |
31 |
7991 |
◊ |
A |
x,y,z |
1_555 |
98 |
29 |
13750 |
957.0 |
-10.4 |
0.307 |
7 |
0 |
0 |
0.402 |
2 |
|
F |
102 |
30 |
7849 |
◊ |
B |
x,y,z |
1_555 |
86 |
25 |
13840 |
863.6 |
-10.5 |
0.249 |
5 |
0 |
0 |
0.402 |
Average: |
910.3 |
-10.5 |
0.278 |
6 |
0 |
0 |
0.402 |
2 |
3 |
|
D |
86 |
23 |
7991 |
◊ |
C |
x,y,z |
1_555 |
95 |
24 |
7908 |
886.7 |
-10.0 |
0.348 |
9 |
0 |
0 |
0.288 |
4 |
|
F |
86 |
24 |
7849 |
◊ |
E |
x,y,z |
1_555 |
93 |
23 |
7808 |
870.5 |
-12.1 |
0.256 |
8 |
0 |
0 |
0.288 |
Average: |
878.6 |
-11.1 |
0.302 |
9 |
0 |
0 |
0.288 |
3 |
5 |
|
[HEM]C:201 |
43 |
1 |
826 |
f |
C |
x,y,z |
1_555 |
67 |
25 |
7908 |
552.6 |
-19.5 |
0.245 |
0 |
0 |
0 |
0.362 |
6 |
|
[HEM]E:201 |
42 |
1 |
824 |
f |
E |
x,y,z |
1_555 |
66 |
25 |
7808 |
550.3 |
-19.7 |
0.257 |
0 |
0 |
0 |
0.362 |
Average: |
551.4 |
-19.6 |
0.251 |
0 |
0 |
0 |
0.362 |
4 |
7 |
|
[HEM]F:201 |
43 |
1 |
827 |
f |
F |
x,y,z |
1_555 |
67 |
27 |
7849 |
552.1 |
-18.3 |
0.363 |
0 |
0 |
0 |
0.575 |
8 |
|
[HEM]D:201 |
43 |
1 |
823 |
f |
D |
x,y,z |
1_555 |
65 |
25 |
7991 |
532.3 |
-18.1 |
0.302 |
0 |
0 |
0 |
0.575 |
Average: |
542.2 |
-18.2 |
0.333 |
0 |
0 |
0 |
0.575 |
5 |
9 |
|
A |
43 |
15 |
13750 |
◊ |
B |
x,y,z-1 |
1_554 |
54 |
19 |
13840 |
473.7 |
1.3 |
0.868 |
4 |
0 |
0 |
0.000 |
6 |
10 |
|
F |
60 |
12 |
7849 |
◊ |
C |
x,y,z |
1_555 |
42 |
12 |
7908 |
444.6 |
-1.9 |
0.698 |
4 |
0 |
0 |
0.070 |
11 |
|
D |
61 |
13 |
7991 |
◊ |
E |
x,y,z |
1_555 |
41 |
12 |
7808 |
431.4 |
-2.5 |
0.659 |
6 |
0 |
0 |
0.070 |
Average: |
438.0 |
-2.2 |
0.679 |
5 |
0 |
0 |
0.070 |
7 |
12 |
|
E |
38 |
13 |
7808 |
◊ |
C |
x,y,z |
1_555 |
38 |
13 |
7908 |
383.4 |
-4.9 |
0.378 |
4 |
0 |
0 |
0.054 |
8 |
13 |
|
C |
43 |
12 |
7908 |
◊ |
B |
-x+3,y-1/2,-z+2 |
2_847 |
34 |
12 |
13840 |
346.0 |
4.5 |
0.935 |
4 |
3 |
0 |
0.000 |
9 |
14 |
|
E |
41 |
13 |
7808 |
◊ |
B |
x,y,z |
1_555 |
36 |
8 |
13840 |
335.3 |
0.2 |
0.588 |
5 |
2 |
0 |
0.034 |
15 |
|
C |
41 |
11 |
7908 |
◊ |
A |
x,y,z |
1_555 |
36 |
11 |
13750 |
329.9 |
-0.4 |
0.607 |
3 |
2 |
0 |
0.034 |
Average: |
332.6 |
-0.1 |
0.597 |
4 |
2 |
0 |
0.034 |
10 |
16 |
|
B |
36 |
14 |
13840 |
◊ |
F |
-x+3,y-1/2,-z+2 |
2_847 |
34 |
11 |
7849 |
317.1 |
0.0 |
0.768 |
4 |
1 |
0 |
0.000 |
11 |
17 |
|
C |
23 |
6 |
7908 |
◊ |
A |
-x+2,y-1/2,-z+1 |
2_746 |
22 |
10 |
13750 |
200.8 |
-5.0 |
0.133 |
0 |
0 |
0 |
0.000 |
12 |
18 |
|
E |
21 |
8 |
7808 |
◊ |
F |
x-1,y,z |
1_455 |
20 |
5 |
7849 |
159.7 |
-1.1 |
0.628 |
3 |
0 |
0 |
0.000 |
13 |
19 |
|
F |
17 |
5 |
7849 |
◊ |
D |
x,y,z |
1_555 |
17 |
5 |
7991 |
155.6 |
0.8 |
0.780 |
2 |
0 |
0 |
0.000 |
14 |
20 |
|
A |
13 |
5 |
13750 |
◊ |
D |
-x+2,y-1/2,-z+1 |
2_746 |
12 |
3 |
7991 |
136.5 |
2.4 |
0.865 |
2 |
3 |
0 |
0.000 |
15 |
21 |
|
[GOL]A:401 |
6 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
23 |
9 |
13750 |
122.4 |
-0.4 |
0.594 |
0 |
0 |
0 |
0.100 |
16 |
22 |
|
[GOL]D:203 |
6 |
1 |
224 |
f |
D |
x,y,z |
1_555 |
20 |
7 |
7991 |
117.5 |
-0.1 |
0.613 |
6 |
0 |
0 |
0.079 |
17 |
23 |
|
A |
14 |
5 |
13750 |
x |
A |
-x+3,y-1/2,-z+1 |
2_846 |
12 |
5 |
13750 |
114.4 |
-0.6 |
0.553 |
1 |
0 |
0 |
0.000 |
18 |
24 |
|
E |
14 |
3 |
7808 |
◊ |
A |
-x+2,y-1/2,-z+1 |
2_746 |
14 |
5 |
13750 |
108.5 |
-0.2 |
0.652 |
1 |
0 |
0 |
0.000 |
19 |
25 |
|
E |
8 |
3 |
7808 |
◊ |
C |
x-1,y,z |
1_455 |
13 |
4 |
7908 |
95.0 |
-0.6 |
0.593 |
0 |
0 |
0 |
0.000 |
20 |
26 |
|
A |
8 |
3 |
13750 |
◊ |
D |
-x+3,y-1/2,-z+1 |
2_846 |
8 |
4 |
7991 |
85.3 |
-1.8 |
0.180 |
0 |
0 |
0 |
0.000 |
21 |
27 |
|
B |
8 |
4 |
13840 |
◊ |
D |
-x+3,y-1/2,-z+2 |
2_847 |
10 |
4 |
7991 |
82.1 |
0.8 |
0.799 |
1 |
2 |
0 |
0.000 |
22 |
28 |
|
C |
8 |
3 |
7908 |
◊ |
A |
-x+3,y-1/2,-z+1 |
2_846 |
7 |
2 |
13750 |
63.5 |
-1.2 |
0.366 |
0 |
0 |
0 |
0.000 |
23 |
29 |
|
D |
8 |
2 |
7991 |
◊ |
C |
x-1,y,z |
1_455 |
9 |
4 |
7908 |
62.7 |
-0.7 |
0.493 |
0 |
0 |
0 |
0.000 |
24 |
30 |
|
[OXY]D:202 |
2 |
1 |
120 |
f |
D |
x,y,z |
1_555 |
10 |
7 |
7991 |
57.0 |
0.4 |
0.764 |
1 |
0 |
0 |
0.002 |
25 |
31 |
|
[OXY]F:202 |
2 |
1 |
119 |
f |
F |
x,y,z |
1_555 |
10 |
7 |
7849 |
56.0 |
0.3 |
0.740 |
1 |
0 |
0 |
0.005 |
26 |
32 |
|
[OXY]C:202 |
2 |
1 |
120 |
f |
C |
x,y,z |
1_555 |
8 |
7 |
7908 |
55.0 |
0.3 |
0.711 |
1 |
0 |
0 |
0.003 |
27 |
33 |
|
[OXY]E:202 |
2 |
1 |
120 |
f |
E |
x,y,z |
1_555 |
9 |
7 |
7808 |
54.8 |
0.3 |
0.722 |
0 |
0 |
0 |
0.000 |
28 |
34 |
|
B |
4 |
2 |
13840 |
x |
B |
-x+3,y-1/2,-z+2 |
2_847 |
4 |
2 |
13840 |
44.6 |
-0.3 |
0.404 |
0 |
0 |
0 |
0.000 |
29 |
35 |
|
[OXY]C:202 |
2 |
1 |
120 |
f |
[HEM]C:201 |
x,y,z |
1_555 |
18 |
1 |
826 |
41.3 |
-0.4 |
1.000 |
0 |
0 |
0 |
0.007 |
30 |
36 |
|
[OXY]E:202 |
2 |
1 |
120 |
f |
[HEM]E:201 |
x,y,z |
1_555 |
19 |
1 |
824 |
40.9 |
-0.4 |
1.000 |
0 |
0 |
0 |
0.007 |
31 |
37 |
|
[OXY]D:202 |
2 |
1 |
120 |
cf |
[HEM]D:201 |
x,y,z |
1_555 |
15 |
1 |
823 |
40.3 |
-0.5 |
1.000 |
0 |
0 |
0 |
0.014 |
32 |
38 |
|
[OXY]F:202 |
2 |
1 |
119 |
cf |
[HEM]F:201 |
x,y,z |
1_555 |
18 |
1 |
827 |
39.8 |
-0.6 |
1.000 |
0 |
0 |
0 |
0.018 |
33 |
39 |
|
B |
5 |
3 |
13840 |
◊ |
[GOL]D:203 |
-x+3,y-1/2,-z+2 |
2_847 |
2 |
1 |
224 |
30.6 |
-0.0 |
0.622 |
1 |
0 |
0 |
0.000 |
34 |
40 |
|
A |
3 |
1 |
13750 |
◊ |
B |
x-1,y,z-1 |
1_454 |
3 |
1 |
13840 |
25.1 |
-0.2 |
0.466 |
0 |
0 |
0 |
0.000 |
35 |
41 |
|
E |
2 |
2 |
7808 |
◊ |
B |
-x+3,y-1/2,-z+2 |
2_847 |
2 |
2 |
13840 |
10.2 |
-0.1 |
0.514 |
0 |
0 |
0 |
0.000 |
36 |
42 |
|
[HEM]E:201 |
4 |
1 |
824 |
◊ |
C |
x-1,y,z |
1_455 |
2 |
1 |
7908 |
9.1 |
-0.4 |
0.650 |
0 |
0 |
0 |
0.000 |
37 |
43 |
|
B |
2 |
1 |
13840 |
◊ |
D |
-x+2,y-1/2,-z+2 |
2_747 |
1 |
1 |
7991 |
8.1 |
-0.1 |
0.428 |
0 |
0 |
0 |
0.000 |
38 |
44 |
|
E |
2 |
1 |
7808 |
◊ |
[HEM]F:201 |
x-1,y,z |
1_455 |
3 |
1 |
827 |
2.1 |
-0.1 |
0.773 |
0 |
0 |
0 |
0.000 |
39 |
45 |
|
E |
1 |
1 |
7808 |
◊ |
[HEM]C:201 |
x-1,y,z |
1_455 |
1 |
1 |
826 |
1.8 |
-0.1 |
0.631 |
0 |
0 |
0 |
0.000 |
40 |
46 |
|
E |
1 |
1 |
7808 |
◊ |
B |
-x+2,y-1/2,-z+2 |
2_747 |
1 |
1 |
13840 |
1.2 |
0.1 |
0.732 |
0 |
0 |
0 |
0.000 |
|