| ## |
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 |
147 |
34 |
9218 |
◊ |
F |
-y+1,x+1,z |
3_665 |
150 |
36 |
9248 |
1376.7 |
-3.6 |
0.544 |
30 |
11 |
0 |
0.429 |
2 |
|
B |
152 |
35 |
9225 |
◊ |
A |
x,y,z |
1_555 |
153 |
37 |
9206 |
1367.3 |
-7.5 |
0.351 |
26 |
12 |
0 |
0.429 |
3 |
|
E |
145 |
34 |
9212 |
◊ |
C |
-y+1,x+1,z |
3_665 |
144 |
36 |
9119 |
1323.0 |
-6.4 |
0.429 |
22 |
10 |
0 |
0.429 |
| Average: |
1355.7 |
-5.8 |
0.441 |
26 |
11 |
0 |
0.429 |
| 2 |
4 |
|
D |
73 |
17 |
9218 |
◊ |
A |
x,y,z |
1_555 |
63 |
15 |
9206 |
672.3 |
-4.0 |
0.303 |
8 |
3 |
0 |
0.190 |
5 |
|
F |
72 |
17 |
9248 |
◊ |
D |
x,y,z |
1_555 |
62 |
16 |
9218 |
671.4 |
-2.8 |
0.367 |
9 |
4 |
0 |
0.190 |
6 |
|
E |
64 |
16 |
9212 |
◊ |
B |
x,y,z |
1_555 |
75 |
17 |
9225 |
670.2 |
-4.1 |
0.317 |
8 |
3 |
0 |
0.190 |
7 |
|
E |
73 |
17 |
9212 |
◊ |
C |
x,y,z |
1_555 |
63 |
17 |
9119 |
663.3 |
-3.6 |
0.309 |
7 |
3 |
0 |
0.190 |
8 |
|
F |
65 |
16 |
9248 |
◊ |
A |
x,y,z |
1_555 |
73 |
17 |
9206 |
661.1 |
-4.6 |
0.281 |
7 |
3 |
0 |
0.190 |
9 |
|
C |
77 |
19 |
9119 |
◊ |
B |
x,y,z |
1_555 |
62 |
16 |
9225 |
657.7 |
-3.9 |
0.305 |
8 |
3 |
0 |
0.190 |
| Average: |
666.0 |
-3.8 |
0.314 |
8 |
3 |
0 |
0.190 |
| 3 |
10 |
|
D |
52 |
14 |
9218 |
x |
A |
-y+1,x+1,z |
3_665 |
54 |
13 |
9206 |
512.0 |
-5.8 |
0.134 |
9 |
2 |
0 |
0.412 |
11 |
|
B |
53 |
13 |
9225 |
x |
C |
-y+1,x+1,z |
3_665 |
51 |
14 |
9119 |
509.6 |
-5.9 |
0.143 |
7 |
2 |
0 |
0.412 |
12 |
|
C |
54 |
12 |
9119 |
x |
A |
x,y,z |
1_555 |
50 |
14 |
9206 |
505.2 |
-5.6 |
0.152 |
7 |
2 |
0 |
0.412 |
13 |
|
D |
53 |
12 |
9218 |
x |
B |
x,y,z |
1_555 |
50 |
14 |
9225 |
504.8 |
-5.8 |
0.132 |
8 |
1 |
0 |
0.412 |
14 |
|
E |
51 |
14 |
9212 |
x |
E |
-y+1,x+1,z |
3_665 |
52 |
12 |
9212 |
503.3 |
-6.1 |
0.121 |
8 |
2 |
0 |
0.412 |
15 |
|
F |
54 |
12 |
9248 |
x |
F |
-y+1,x+1,z |
3_665 |
50 |
14 |
9248 |
501.6 |
-5.7 |
0.141 |
8 |
2 |
0 |
0.412 |
| Average: |
506.1 |
-5.8 |
0.137 |
8 |
2 |
0 |
0.412 |
| 4 |
16 |
|
F |
24 |
7 |
9248 |
◊ |
E |
-y+3/2,x+3/2,z+1/2 |
7_665 |
25 |
8 |
9212 |
217.8 |
0.2 |
0.628 |
3 |
0 |
0 |
0.000 |
17 |
|
C |
27 |
8 |
9119 |
◊ |
D |
-y+3/2,x+3/2,z-1/2 |
7_664 |
24 |
8 |
9218 |
197.2 |
0.2 |
0.639 |
3 |
0 |
0 |
0.000 |
| Average: |
207.5 |
0.2 |
0.633 |
3 |
0 |
0 |
0.000 |
| 5 |
18 |
|
A |
27 |
10 |
9206 |
◊ |
A |
-x,-y+3,z |
2_585 |
27 |
10 |
9206 |
190.9 |
2.4 |
0.854 |
2 |
0 |
0 |
0.000 |
| 6 |
19 |
|
C |
20 |
5 |
9119 |
◊ |
F |
-x+1/2,-y+5/2,z-1/2 |
6_574 |
22 |
5 |
9248 |
188.6 |
-0.2 |
0.606 |
2 |
0 |
0 |
0.000 |
| 7 |
20 |
|
B |
21 |
8 |
9225 |
◊ |
B |
-x,-y+3,z |
2_585 |
21 |
8 |
9225 |
175.5 |
0.4 |
0.658 |
2 |
0 |
0 |
0.000 |
| 8 |
21 |
|
B |
9 |
5 |
9225 |
◊ |
A |
-x,-y+3,z |
2_585 |
9 |
3 |
9206 |
75.9 |
-0.8 |
0.365 |
0 |
0 |
0 |
0.000 |
| 9 |
22 |
|
[FE]A:201 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
10 |
7 |
9206 |
72.3 |
-13.9 |
0.000 |
0 |
0 |
0 |
0.610 |
23 |
|
[FE]F:201 |
1 |
1 |
137 |
f |
F |
x,y,z |
1_555 |
8 |
6 |
9248 |
72.3 |
-13.8 |
0.000 |
0 |
0 |
0 |
0.610 |
24 |
|
[FE]B:201 |
1 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
9225 |
72.1 |
-13.9 |
0.000 |
0 |
0 |
0 |
0.610 |
25 |
|
[FE]D:201 |
1 |
1 |
137 |
f |
D |
x,y,z |
1_555 |
10 |
7 |
9218 |
72.0 |
-13.8 |
0.000 |
0 |
0 |
0 |
0.610 |
26 |
|
[FE]E:201 |
1 |
1 |
137 |
f |
E |
x,y,z |
1_555 |
9 |
7 |
9212 |
71.7 |
-13.8 |
0.000 |
0 |
0 |
0 |
0.610 |
27 |
|
[FE]C:201 |
1 |
1 |
137 |
f |
C |
x,y,z |
1_555 |
9 |
7 |
9119 |
71.7 |
-13.8 |
0.000 |
0 |
0 |
0 |
0.610 |
| Average: |
72.0 |
-13.8 |
0.000 |
0 |
0 |
0 |
0.610 |
| 10 |
28 |
|
B |
3 |
2 |
9225 |
◊ |
A |
-y+1,x+1,z |
3_665 |
2 |
2 |
9206 |
29.6 |
-1.0 |
0.142 |
0 |
0 |
0 |
0.019 |
29 |
|
E |
2 |
2 |
9212 |
◊ |
E |
-x,-y+2,z |
2_575 |
2 |
2 |
9212 |
28.5 |
-0.9 |
0.115 |
0 |
0 |
0 |
0.019 |
30 |
|
F |
2 |
2 |
9248 |
◊ |
F |
-x,-y+2,z |
2_575 |
2 |
2 |
9248 |
25.8 |
-0.8 |
0.138 |
0 |
0 |
0 |
0.019 |
31 |
|
D |
2 |
2 |
9218 |
◊ |
C |
-y+1,x+1,z |
3_665 |
2 |
2 |
9119 |
17.7 |
-0.6 |
0.227 |
0 |
0 |
0 |
0.019 |
| Average: |
25.4 |
-0.8 |
0.155 |
0 |
0 |
0 |
0.019 |
|