## |
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 |
|
A |
85 |
22 |
17036 |
◊ |
F |
-x+1/2,y-1/2,-z+1 |
4_546 |
83 |
25 |
17112 |
787.5 |
-1.1 |
0.654 |
9 |
9 |
0 |
0.000 |
2 |
|
C |
76 |
24 |
17097 |
◊ |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
79 |
21 |
17615 |
725.7 |
-0.3 |
0.712 |
9 |
8 |
0 |
0.000 |
3 |
|
E |
76 |
20 |
17081 |
◊ |
D |
x,y,z |
1_555 |
78 |
24 |
17254 |
696.5 |
-0.8 |
0.653 |
8 |
11 |
0 |
0.000 |
Average: |
736.6 |
-0.7 |
0.673 |
9 |
9 |
0 |
0.000 |
2 |
4 |
|
A |
79 |
25 |
17036 |
◊ |
D |
-x-1/2,y-1/2,-z |
4_445 |
83 |
21 |
17254 |
782.9 |
-3.0 |
0.481 |
9 |
17 |
0 |
0.000 |
3 |
5 |
|
C |
86 |
22 |
17097 |
◊ |
B |
x,y,z |
1_555 |
82 |
22 |
17615 |
762.4 |
-2.0 |
0.614 |
10 |
11 |
0 |
0.000 |
6 |
|
A |
65 |
18 |
17036 |
◊ |
B |
x-1/2,y-1/2,z |
3_445 |
69 |
18 |
17615 |
602.9 |
0.6 |
0.711 |
7 |
8 |
0 |
0.000 |
7 |
|
D |
55 |
16 |
17254 |
◊ |
A |
x,y,z |
1_555 |
61 |
15 |
17036 |
530.4 |
-0.0 |
0.665 |
7 |
8 |
0 |
0.000 |
8 |
|
D |
57 |
14 |
17254 |
◊ |
C |
x-1/2,y+1/2,z-1 |
3_454 |
56 |
16 |
17097 |
498.3 |
1.2 |
0.750 |
6 |
8 |
0 |
0.000 |
Average: |
598.5 |
-0.1 |
0.685 |
8 |
9 |
0 |
0.000 |
4 |
9 |
|
F |
71 |
21 |
17112 |
◊ |
B |
x,y,z |
1_555 |
73 |
23 |
17615 |
655.8 |
-1.9 |
0.593 |
7 |
9 |
0 |
0.000 |
10 |
|
C |
61 |
18 |
17097 |
◊ |
E |
-x+1/2,y-1/2,-z+1 |
4_546 |
68 |
21 |
17081 |
600.9 |
-1.6 |
0.571 |
7 |
9 |
0 |
0.000 |
Average: |
628.3 |
-1.7 |
0.582 |
7 |
9 |
0 |
0.000 |
5 |
11 |
|
[HEM]F:702 |
42 |
1 |
812 |
f |
F |
x,y,z |
1_555 |
84 |
33 |
17112 |
580.1 |
-23.7 |
0.139 |
6 |
0 |
0 |
0.054 |
12 |
|
[HEM]C:501 |
43 |
1 |
815 |
f |
C |
x,y,z |
1_555 |
85 |
34 |
17097 |
578.8 |
-23.9 |
0.136 |
5 |
0 |
0 |
0.054 |
13 |
|
[HEM]E:501 |
42 |
1 |
806 |
f |
E |
x,y,z |
1_555 |
86 |
34 |
17081 |
577.2 |
-23.6 |
0.128 |
5 |
0 |
0 |
0.054 |
14 |
|
[HEM]B:501 |
43 |
1 |
810 |
f |
B |
x,y,z |
1_555 |
85 |
34 |
17615 |
576.5 |
-23.8 |
0.147 |
6 |
0 |
0 |
0.054 |
15 |
|
[HEM]D:501 |
42 |
1 |
808 |
f |
D |
x,y,z |
1_555 |
85 |
34 |
17254 |
576.4 |
-22.9 |
0.167 |
5 |
0 |
0 |
0.054 |
16 |
|
[HEM]A:501 |
40 |
1 |
812 |
f |
A |
x,y,z |
1_555 |
84 |
34 |
17036 |
575.2 |
-23.9 |
0.112 |
6 |
0 |
0 |
0.054 |
Average: |
577.4 |
-23.6 |
0.138 |
6 |
0 |
0 |
0.054 |
6 |
17 |
|
E |
62 |
14 |
17081 |
◊ |
F |
-x+1/2,y-1/2,-z+1 |
4_546 |
60 |
18 |
17112 |
538.3 |
1.0 |
0.771 |
6 |
8 |
0 |
0.000 |
7 |
18 |
|
C |
55 |
20 |
17097 |
◊ |
A |
-x,y,-z+1 |
2_556 |
56 |
20 |
17036 |
449.0 |
-6.5 |
0.140 |
1 |
0 |
0 |
0.000 |
19 |
|
D |
38 |
14 |
17254 |
◊ |
F |
-x+1/2,y-1/2,-z+1 |
4_546 |
33 |
13 |
17112 |
290.9 |
-4.7 |
0.153 |
1 |
0 |
0 |
0.000 |
Average: |
369.9 |
-5.6 |
0.147 |
1 |
0 |
0 |
0.000 |
8 |
20 |
|
[DEB]F:703 |
23 |
1 |
551 |
f |
F |
x,y,z |
1_555 |
50 |
20 |
17112 |
353.9 |
-9.1 |
0.136 |
0 |
0 |
0 |
0.019 |
21 |
|
[DEB]B:502 |
25 |
1 |
556 |
f |
B |
x,y,z |
1_555 |
49 |
20 |
17615 |
346.1 |
-8.9 |
0.135 |
0 |
0 |
0 |
0.019 |
22 |
|
[DEB]E:502 |
23 |
1 |
556 |
f |
E |
x,y,z |
1_555 |
45 |
19 |
17081 |
345.2 |
-9.1 |
0.114 |
0 |
0 |
0 |
0.019 |
23 |
|
[DEB]A:502 |
25 |
1 |
552 |
f |
A |
x,y,z |
1_555 |
48 |
19 |
17036 |
338.4 |
-8.7 |
0.133 |
0 |
0 |
0 |
0.019 |
24 |
|
[DEB]D:502 |
25 |
1 |
554 |
f |
D |
x,y,z |
1_555 |
47 |
19 |
17254 |
334.1 |
-8.6 |
0.120 |
0 |
0 |
0 |
0.019 |
25 |
|
[DEB]C:502 |
23 |
1 |
552 |
f |
C |
x,y,z |
1_555 |
47 |
19 |
17097 |
322.2 |
-8.6 |
0.132 |
0 |
0 |
0 |
0.019 |
Average: |
340.0 |
-8.8 |
0.128 |
0 |
0 |
0 |
0.019 |
9 |
26 |
|
[TRS]F:705 |
7 |
1 |
256 |
◊ |
F |
x,y,z |
1_555 |
27 |
13 |
17112 |
174.1 |
3.7 |
0.452 |
5 |
0 |
0 |
0.000 |
10 |
27 |
|
[RAM]A:503 |
11 |
1 |
292 |
f |
A |
x,y,z |
1_555 |
26 |
11 |
17036 |
169.0 |
2.9 |
0.450 |
3 |
0 |
0 |
0.000 |
11 |
28 |
|
[RAM]D:503 |
10 |
1 |
291 |
f |
D |
x,y,z |
1_555 |
32 |
14 |
17254 |
168.5 |
2.6 |
0.464 |
4 |
0 |
0 |
0.000 |
12 |
29 |
|
[RAM]E:503 |
11 |
1 |
286 |
f |
E |
x,y,z |
1_555 |
29 |
13 |
17081 |
160.0 |
2.9 |
0.471 |
4 |
0 |
0 |
0.000 |
13 |
30 |
|
[RAM]B:503 |
11 |
1 |
290 |
f |
B |
x,y,z |
1_555 |
25 |
11 |
17615 |
159.9 |
3.0 |
0.454 |
3 |
0 |
0 |
0.000 |
14 |
31 |
|
[GOL]C:505 |
6 |
1 |
220 |
f |
C |
x,y,z |
1_555 |
28 |
12 |
17097 |
154.9 |
-1.3 |
0.433 |
4 |
0 |
0 |
0.006 |
15 |
32 |
|
[RAM]C:503 |
11 |
1 |
288 |
f |
C |
x,y,z |
1_555 |
29 |
12 |
17097 |
146.8 |
1.8 |
0.366 |
2 |
0 |
0 |
0.000 |
16 |
33 |
|
[TRS]A:504 |
7 |
1 |
255 |
f |
A |
x,y,z |
1_555 |
25 |
7 |
17036 |
145.4 |
4.2 |
0.400 |
4 |
0 |
0 |
0.000 |
17 |
34 |
|
[GOL]B:506 |
6 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
26 |
7 |
17615 |
132.9 |
-0.8 |
0.492 |
3 |
0 |
0 |
0.004 |
18 |
35 |
|
[RAM]C:504 |
9 |
1 |
290 |
f |
C |
x,y,z |
1_555 |
14 |
7 |
17097 |
130.3 |
3.0 |
0.506 |
0 |
0 |
0 |
0.000 |
19 |
36 |
|
[TRS]B:504 |
7 |
1 |
255 |
◊ |
B |
x,y,z |
1_555 |
20 |
6 |
17615 |
121.8 |
2.7 |
0.112 |
1 |
0 |
0 |
0.000 |
20 |
37 |
|
[GOL]F:704 |
6 |
1 |
221 |
f |
F |
x,y,z |
1_555 |
18 |
9 |
17112 |
120.8 |
-0.8 |
0.447 |
0 |
0 |
0 |
0.002 |
21 |
38 |
|
[GOL]C:506 |
6 |
1 |
219 |
f |
C |
x,y,z |
1_555 |
23 |
7 |
17097 |
119.8 |
-1.5 |
0.367 |
4 |
0 |
0 |
0.006 |
22 |
39 |
|
[RAM]F:701 |
10 |
1 |
294 |
f |
B |
x,y,z |
1_555 |
19 |
7 |
17615 |
113.4 |
1.1 |
0.278 |
1 |
0 |
0 |
0.000 |
23 |
40 |
|
[GOL]B:505 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
19 |
7 |
17615 |
109.3 |
-0.1 |
0.611 |
3 |
0 |
0 |
0.003 |
24 |
41 |
|
[GOL]C:507 |
6 |
1 |
219 |
f |
C |
x,y,z |
1_555 |
23 |
11 |
17097 |
105.9 |
-0.4 |
0.508 |
5 |
0 |
0 |
0.005 |
25 |
42 |
|
[DEB]F:703 |
9 |
1 |
551 |
f |
[HEM]F:702 |
x,y,z |
1_555 |
25 |
1 |
812 |
100.2 |
-2.4 |
0.888 |
0 |
0 |
0 |
0.005 |
43 |
|
[DEB]A:502 |
8 |
1 |
552 |
f |
[HEM]A:501 |
x,y,z |
1_555 |
25 |
1 |
812 |
98.6 |
-2.5 |
0.857 |
0 |
0 |
0 |
0.005 |
44 |
|
[DEB]B:502 |
7 |
1 |
556 |
f |
[HEM]B:501 |
x,y,z |
1_555 |
26 |
1 |
810 |
98.5 |
-2.5 |
0.845 |
0 |
0 |
0 |
0.005 |
45 |
|
[DEB]E:502 |
7 |
1 |
556 |
f |
[HEM]E:501 |
x,y,z |
1_555 |
26 |
1 |
806 |
98.0 |
-2.4 |
0.865 |
0 |
0 |
0 |
0.005 |
46 |
|
[DEB]D:502 |
8 |
1 |
554 |
f |
[HEM]D:501 |
x,y,z |
1_555 |
26 |
1 |
808 |
96.8 |
-2.3 |
0.874 |
0 |
0 |
0 |
0.005 |
47 |
|
[DEB]C:502 |
7 |
1 |
552 |
f |
[HEM]C:501 |
x,y,z |
1_555 |
26 |
1 |
815 |
94.6 |
-2.4 |
0.863 |
0 |
0 |
0 |
0.005 |
Average: |
97.8 |
-2.4 |
0.865 |
0 |
0 |
0 |
0.005 |
26 |
48 |
|
B |
10 |
4 |
17615 |
◊ |
E |
-x+1/2,y-1/2,-z+1 |
4_546 |
12 |
5 |
17081 |
91.7 |
-1.1 |
0.356 |
0 |
0 |
0 |
0.000 |
27 |
49 |
|
E |
9 |
3 |
17081 |
◊ |
C |
x,y,z |
1_555 |
7 |
3 |
17097 |
75.0 |
1.0 |
0.809 |
1 |
0 |
0 |
0.000 |
50 |
|
B |
9 |
3 |
17615 |
◊ |
B |
-x+1,y,-z+1 |
2_656 |
9 |
3 |
17615 |
68.3 |
1.0 |
0.809 |
0 |
0 |
0 |
0.000 |
Average: |
71.7 |
1.0 |
0.809 |
1 |
0 |
0 |
0.000 |
28 |
51 |
|
[NA]B:570 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
18 |
9 |
17615 |
70.2 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.026 |
52 |
|
[NA]E:515 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
18 |
9 |
17081 |
69.7 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.026 |
53 |
|
[NA]A:546 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
17036 |
69.5 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.026 |
54 |
|
[NA]C:566 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
18 |
9 |
17097 |
68.9 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.026 |
55 |
|
[NA]D:520 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
20 |
9 |
17254 |
67.6 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.026 |
56 |
|
[NA]F:720 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
18 |
9 |
17112 |
67.0 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.026 |
Average: |
68.8 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.026 |
29 |
57 |
|
[RAM]D:503 |
6 |
1 |
291 |
f |
[DEB]D:502 |
x,y,z |
1_555 |
8 |
1 |
554 |
66.3 |
0.4 |
0.467 |
1 |
0 |
0 |
0.000 |
30 |
58 |
|
[NA]A:547 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
17036 |
65.8 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.021 |
31 |
59 |
|
D |
8 |
3 |
17254 |
◊ |
D |
-x,y,-z |
2_555 |
8 |
3 |
17254 |
62.7 |
0.4 |
0.721 |
0 |
0 |
0 |
0.000 |
32 |
60 |
|
[RAM]A:503 |
7 |
1 |
292 |
f |
[DEB]A:502 |
x,y,z |
1_555 |
7 |
1 |
552 |
62.3 |
-0.2 |
0.299 |
1 |
0 |
0 |
0.001 |
33 |
61 |
|
[RAM]E:503 |
6 |
1 |
286 |
f |
[DEB]E:502 |
x,y,z |
1_555 |
6 |
1 |
556 |
59.5 |
0.7 |
0.450 |
0 |
0 |
0 |
0.000 |
34 |
62 |
|
[RAM]B:503 |
5 |
1 |
290 |
f |
[DEB]B:502 |
x,y,z |
1_555 |
7 |
1 |
556 |
56.8 |
-0.1 |
0.354 |
2 |
0 |
0 |
0.002 |
35 |
63 |
|
[RAM]C:503 |
7 |
1 |
288 |
f |
[DEB]C:502 |
x,y,z |
1_555 |
5 |
1 |
552 |
49.7 |
0.7 |
0.414 |
1 |
0 |
0 |
0.000 |
36 |
64 |
|
[RAM]F:701 |
2 |
1 |
294 |
◊ |
F |
x,y,z |
1_555 |
5 |
3 |
17112 |
45.5 |
1.3 |
0.683 |
0 |
0 |
0 |
0.000 |
37 |
65 |
|
[GOL]F:704 |
3 |
1 |
221 |
f |
[DEB]F:703 |
x,y,z |
1_555 |
6 |
1 |
551 |
44.5 |
0.1 |
0.696 |
2 |
0 |
0 |
0.001 |
38 |
66 |
|
[GOL]C:507 |
5 |
1 |
219 |
f |
[RAM]C:503 |
x,y,z |
1_555 |
5 |
1 |
288 |
43.0 |
1.0 |
0.393 |
1 |
0 |
0 |
0.000 |
39 |
67 |
|
[GOL]C:507 |
3 |
1 |
219 |
f |
[DEB]C:502 |
x,y,z |
1_555 |
3 |
1 |
552 |
35.8 |
-0.4 |
0.569 |
1 |
0 |
0 |
0.001 |
40 |
68 |
|
E |
3 |
1 |
17081 |
◊ |
D |
-x,y,-z |
2_555 |
4 |
3 |
17254 |
16.5 |
0.2 |
0.712 |
0 |
0 |
0 |
0.000 |
69 |
|
E |
1 |
1 |
17081 |
◊ |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
17615 |
3.4 |
0.1 |
0.765 |
0 |
0 |
0 |
0.000 |
Average: |
9.9 |
0.1 |
0.738 |
0 |
0 |
0 |
0.000 |
41 |
70 |
|
[NA]D:520 |
1 |
1 |
125 |
f |
[DEB]D:502 |
x,y,z |
1_555 |
2 |
1 |
554 |
8.2 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.002 |
71 |
|
[NA]F:720 |
1 |
1 |
125 |
f |
[DEB]F:703 |
x,y,z |
1_555 |
2 |
1 |
551 |
5.1 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.002 |
72 |
|
[NA]C:566 |
1 |
1 |
125 |
f |
[DEB]C:502 |
x,y,z |
1_555 |
2 |
1 |
552 |
3.8 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.002 |
73 |
|
[NA]A:546 |
1 |
1 |
125 |
f |
[DEB]A:502 |
x,y,z |
1_555 |
2 |
1 |
552 |
2.6 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.002 |
74 |
|
[NA]B:570 |
1 |
1 |
125 |
f |
[DEB]B:502 |
x,y,z |
1_555 |
1 |
1 |
556 |
1.0 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.002 |
75 |
|
[NA]E:515 |
1 |
1 |
125 |
f |
[DEB]E:502 |
x,y,z |
1_555 |
1 |
1 |
556 |
0.3 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.002 |
Average: |
3.5 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.002 |
42 |
76 |
|
[TRS]F:705 |
3 |
1 |
256 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
17615 |
6.5 |
-0.0 |
0.515 |
0 |
0 |
0 |
0.000 |
43 |
77 |
|
[GOL]B:505 |
1 |
1 |
220 |
f |
[RAM]B:503 |
x,y,z |
1_555 |
1 |
1 |
290 |
2.8 |
0.1 |
0.302 |
0 |
0 |
0 |
0.000 |
44 |
78 |
|
[GOL]C:505 |
3 |
1 |
220 |
◊ |
E |
-x+1/2,y-1/2,-z+1 |
4_546 |
2 |
2 |
17081 |
2.7 |
-0.1 |
0.509 |
0 |
0 |
0 |
0.000 |
45 |
79 |
|
[TRS]B:504 |
1 |
1 |
255 |
f |
B |
-x+1,y,-z+1 |
2_656 |
1 |
1 |
17615 |
0.4 |
0.0 |
0.807 |
0 |
0 |
0 |
0.000 |
|