## |
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 |
|
I |
149 |
43 |
18017 |
◊ |
G |
x,y,z |
1_555 |
140 |
40 |
17908 |
1344.4 |
-5.2 |
0.548 |
19 |
2 |
0 |
0.376 |
2 |
|
E |
150 |
43 |
17718 |
◊ |
A |
x,y,z |
1_555 |
143 |
41 |
17439 |
1340.4 |
-5.1 |
0.532 |
18 |
1 |
0 |
0.376 |
3 |
|
F |
149 |
42 |
18039 |
◊ |
B |
x,y,z |
1_555 |
138 |
41 |
17471 |
1317.4 |
-5.7 |
0.549 |
18 |
2 |
0 |
0.376 |
4 |
|
L |
143 |
40 |
17745 |
◊ |
D |
x,y,z |
1_555 |
134 |
39 |
17089 |
1310.4 |
-7.0 |
0.437 |
19 |
0 |
0 |
0.376 |
5 |
|
K |
140 |
41 |
17859 |
◊ |
J |
x,y,z |
1_555 |
138 |
40 |
17518 |
1304.4 |
-5.4 |
0.499 |
18 |
1 |
0 |
0.376 |
6 |
|
H |
147 |
42 |
17548 |
◊ |
C |
x,y,z |
1_555 |
141 |
42 |
17746 |
1301.3 |
-8.3 |
0.365 |
16 |
1 |
0 |
0.376 |
Average: |
1319.7 |
-6.1 |
0.488 |
18 |
1 |
0 |
0.376 |
2 |
7 |
|
H |
109 |
26 |
17548 |
◊ |
D |
x,y,z |
1_555 |
107 |
25 |
17089 |
880.2 |
-13.8 |
0.055 |
2 |
0 |
0 |
0.356 |
8 |
|
K |
109 |
25 |
17859 |
◊ |
G |
x,y,z |
1_555 |
107 |
26 |
17908 |
879.7 |
-13.5 |
0.056 |
3 |
0 |
0 |
0.356 |
9 |
|
B |
109 |
26 |
17471 |
◊ |
A |
x,y,z |
1_555 |
103 |
25 |
17439 |
877.1 |
-13.7 |
0.064 |
2 |
0 |
0 |
0.356 |
10 |
|
I |
108 |
26 |
18017 |
◊ |
F |
x,y,z |
1_555 |
106 |
25 |
18039 |
875.9 |
-13.5 |
0.075 |
2 |
0 |
0 |
0.356 |
11 |
|
L |
106 |
26 |
17745 |
◊ |
E |
x,y,z |
1_555 |
104 |
25 |
17718 |
873.2 |
-13.3 |
0.060 |
2 |
0 |
0 |
0.356 |
12 |
|
J |
106 |
26 |
17518 |
◊ |
C |
x,y,z |
1_555 |
107 |
26 |
17746 |
872.3 |
-13.2 |
0.065 |
2 |
0 |
0 |
0.356 |
Average: |
876.4 |
-13.5 |
0.063 |
2 |
0 |
0 |
0.356 |
3 |
13 |
|
E |
52 |
16 |
17718 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
52 |
16 |
17746 |
422.5 |
-3.5 |
0.372 |
2 |
0 |
0 |
0.000 |
4 |
14 |
|
B |
32 |
9 |
17471 |
◊ |
K |
-x+1,y-1/2,-z+1 |
2_646 |
41 |
11 |
17859 |
359.1 |
-1.7 |
0.273 |
1 |
0 |
0 |
0.000 |
5 |
15 |
|
K |
20 |
7 |
17859 |
◊ |
J |
x-1,y,z |
1_455 |
22 |
8 |
17518 |
182.4 |
-1.1 |
0.480 |
3 |
0 |
0 |
0.000 |
6 |
16 |
|
E |
17 |
6 |
17718 |
◊ |
F |
x-1,y,z |
1_455 |
17 |
5 |
18039 |
145.2 |
0.4 |
0.698 |
1 |
1 |
0 |
0.000 |
7 |
17 |
|
D |
20 |
6 |
17089 |
◊ |
F |
x-1,y,z-1 |
1_454 |
18 |
8 |
18039 |
144.8 |
-1.8 |
0.370 |
0 |
0 |
0 |
0.000 |
8 |
18 |
|
L |
18 |
8 |
17745 |
◊ |
I |
x,y,z-1 |
1_554 |
14 |
7 |
18017 |
138.0 |
-1.2 |
0.433 |
0 |
0 |
0 |
0.000 |
9 |
19 |
|
I |
12 |
6 |
18017 |
◊ |
G |
x-1,y,z |
1_455 |
12 |
4 |
17908 |
109.7 |
1.0 |
0.790 |
1 |
1 |
0 |
0.000 |
20 |
|
C |
12 |
7 |
17746 |
◊ |
H |
x-1,y,z |
1_455 |
11 |
5 |
17548 |
89.9 |
-0.2 |
0.518 |
0 |
0 |
0 |
0.000 |
Average: |
99.8 |
0.4 |
0.654 |
1 |
1 |
0 |
0.000 |
10 |
21 |
|
H |
10 |
4 |
17548 |
◊ |
I |
x,y,z-1 |
1_554 |
8 |
2 |
18017 |
89.9 |
0.9 |
0.534 |
1 |
3 |
0 |
0.000 |
11 |
22 |
|
L |
7 |
3 |
17745 |
◊ |
J |
-x+1,y-1/2,-z |
2_645 |
7 |
3 |
17518 |
85.4 |
-1.5 |
0.187 |
0 |
0 |
0 |
0.000 |
12 |
23 |
|
[EDO]C:502 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
13 |
5 |
17746 |
84.6 |
2.1 |
0.252 |
1 |
0 |
0 |
0.000 |
13 |
24 |
|
[EDO]L:502 |
4 |
1 |
183 |
◊ |
L |
x,y,z |
1_555 |
11 |
4 |
17745 |
82.9 |
2.4 |
0.301 |
2 |
0 |
0 |
0.000 |
14 |
25 |
|
[EDO]I:502 |
4 |
1 |
181 |
◊ |
I |
x,y,z |
1_555 |
14 |
5 |
18017 |
82.3 |
2.7 |
0.452 |
0 |
0 |
0 |
0.000 |
15 |
26 |
|
[EDO]J:502 |
4 |
1 |
182 |
f |
J |
x,y,z |
1_555 |
13 |
4 |
17518 |
80.3 |
2.3 |
0.270 |
1 |
0 |
0 |
0.000 |
16 |
27 |
|
[EDO]I:503 |
4 |
1 |
184 |
◊ |
I |
x,y,z |
1_555 |
8 |
5 |
18017 |
73.2 |
2.2 |
0.896 |
1 |
0 |
0 |
0.000 |
17 |
28 |
|
[FE]E:1400 |
1 |
1 |
137 |
f |
E |
x,y,z |
1_555 |
7 |
7 |
17718 |
69.5 |
-13.7 |
0.000 |
0 |
0 |
0 |
0.664 |
29 |
|
[FE]J:501 |
1 |
1 |
137 |
f |
J |
x,y,z |
1_555 |
6 |
5 |
17518 |
69.4 |
-13.7 |
0.000 |
0 |
0 |
0 |
0.664 |
30 |
|
[FE]H:501 |
1 |
1 |
137 |
f |
H |
x,y,z |
1_555 |
8 |
7 |
17548 |
69.4 |
-13.7 |
0.000 |
0 |
0 |
0 |
0.664 |
31 |
|
[FE]G:1400 |
1 |
1 |
137 |
f |
G |
x,y,z |
1_555 |
6 |
6 |
17908 |
69.1 |
-13.7 |
0.000 |
0 |
0 |
0 |
0.664 |
32 |
|
[FE]A:501 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
6 |
6 |
17439 |
69.1 |
-13.7 |
0.000 |
0 |
0 |
0 |
0.664 |
33 |
|
[FE]F:501 |
1 |
1 |
137 |
f |
F |
x,y,z |
1_555 |
6 |
6 |
18039 |
69.0 |
-13.7 |
0.000 |
0 |
0 |
0 |
0.664 |
34 |
|
[FE]I:501 |
1 |
1 |
137 |
f |
I |
x,y,z |
1_555 |
4 |
4 |
18017 |
69.0 |
-13.7 |
0.000 |
0 |
0 |
0 |
0.664 |
35 |
|
[FE]C:501 |
1 |
1 |
137 |
f |
C |
x,y,z |
1_555 |
4 |
3 |
17746 |
68.9 |
-13.7 |
0.000 |
0 |
0 |
0 |
0.664 |
36 |
|
[FE]K:501 |
1 |
1 |
137 |
f |
K |
x,y,z |
1_555 |
5 |
5 |
17859 |
68.9 |
-13.7 |
0.000 |
0 |
0 |
0 |
0.664 |
37 |
|
[FE]L:501 |
1 |
1 |
137 |
f |
L |
x,y,z |
1_555 |
3 |
3 |
17745 |
68.8 |
-13.7 |
0.000 |
0 |
0 |
0 |
0.664 |
38 |
|
[FE]B:501 |
1 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
4 |
4 |
17471 |
68.7 |
-13.7 |
0.000 |
0 |
0 |
0 |
0.664 |
39 |
|
[FE]D:501 |
1 |
1 |
137 |
f |
D |
x,y,z |
1_555 |
3 |
3 |
17089 |
68.6 |
-13.7 |
0.000 |
0 |
0 |
0 |
0.664 |
Average: |
69.0 |
-13.7 |
0.000 |
0 |
0 |
0 |
0.664 |
18 |
40 |
|
D |
6 |
3 |
17089 |
◊ |
I |
x-1,y,z-1 |
1_454 |
6 |
2 |
18017 |
62.6 |
-0.4 |
0.476 |
0 |
0 |
0 |
0.000 |
19 |
41 |
|
[EDO]I:503 |
4 |
1 |
184 |
f |
F |
x,y,z |
1_555 |
11 |
2 |
18039 |
58.6 |
0.7 |
0.539 |
0 |
0 |
0 |
0.000 |
20 |
42 |
|
D |
3 |
1 |
17089 |
◊ |
B |
x,y,z-1 |
1_554 |
6 |
4 |
17471 |
37.4 |
0.3 |
0.555 |
1 |
0 |
0 |
0.000 |
21 |
43 |
|
D |
5 |
2 |
17089 |
◊ |
A |
x-1,y,z |
1_455 |
5 |
2 |
17439 |
33.7 |
0.7 |
0.823 |
0 |
0 |
0 |
0.000 |
22 |
44 |
|
H |
5 |
4 |
17548 |
◊ |
G |
x-1,y,z-1 |
1_454 |
8 |
4 |
17908 |
32.9 |
-0.5 |
0.383 |
0 |
0 |
0 |
0.000 |
23 |
45 |
|
[EDO]I:502 |
2 |
1 |
181 |
f |
G |
x,y,z |
1_555 |
3 |
1 |
17908 |
13.4 |
0.6 |
0.895 |
0 |
0 |
0 |
0.000 |
24 |
46 |
|
[EDO]L:502 |
2 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
2 |
1 |
17089 |
5.6 |
0.0 |
0.653 |
0 |
0 |
0 |
0.000 |
25 |
47 |
|
D |
1 |
1 |
17089 |
◊ |
G |
x-1,y,z-1 |
1_454 |
1 |
1 |
17908 |
1.2 |
-0.0 |
0.469 |
0 |
0 |
0 |
0.000 |
26 |
48 |
|
D |
1 |
1 |
17089 |
◊ |
L |
x-1,y,z |
1_455 |
1 |
1 |
17745 |
0.8 |
-0.0 |
0.609 |
0 |
0 |
0 |
0.000 |
|