Tantalum in PDB 3rwr: Crystal Structure of the Human XRCC4-Xlf Complex
Protein crystallography data
The structure of Crystal Structure of the Human XRCC4-Xlf Complex, PDB code: 3rwr
was solved by
S.N.Andres,
M.S.Junop,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
49.03 /
3.94
|
Space group
|
C 1 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
745.379,
149.585,
80.475,
90.00,
94.72,
90.00
|
R / Rfree (%)
|
27.1 /
32.6
|
Other elements in 3rwr:
The structure of Crystal Structure of the Human XRCC4-Xlf Complex also contains other interesting chemical elements:
Tantalum Binding Sites:
Tantalum binding site 1 out
of 48 in 3rwr
Go back to
Tantalum Binding Sites List in 3rwr
Tantalum binding site 1 out
of 48 in the Crystal Structure of the Human XRCC4-Xlf Complex
Mono view
Stereo pair view
|
A full contact list of Tantalum with other atoms in the Ta binding
site number 1 of Crystal Structure of the Human XRCC4-Xlf Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Ta231
b:0.9
occ:0.16
|
TA1
|
D:TBR231
|
0.0
|
0.9
|
0.2
|
BR3
|
D:TBR231
|
2.6
|
0.8
|
0.2
|
BR2
|
D:TBR231
|
2.6
|
0.4
|
0.2
|
BR1
|
D:TBR231
|
2.6
|
0.0
|
0.2
|
BR4
|
D:TBR231
|
2.6
|
0.6
|
0.2
|
TA5
|
D:TBR231
|
2.9
|
1.0
|
0.2
|
TA2
|
D:TBR231
|
2.9
|
0.3
|
0.2
|
TA6
|
D:TBR231
|
2.9
|
0.8
|
0.2
|
TA3
|
D:TBR231
|
2.9
|
0.4
|
0.2
|
TA4
|
D:TBR231
|
4.1
|
0.9
|
0.2
|
BR6
|
D:TBR231
|
4.1
|
0.6
|
0.2
|
BRC
|
D:TBR231
|
4.2
|
0.5
|
0.2
|
BRB
|
D:TBR231
|
4.2
|
0.8
|
0.2
|
BR5
|
D:TBR231
|
4.2
|
0.3
|
0.2
|
|
Tantalum binding site 2 out
of 48 in 3rwr
Go back to
Tantalum Binding Sites List in 3rwr
Tantalum binding site 2 out
of 48 in the Crystal Structure of the Human XRCC4-Xlf Complex
Mono view
Stereo pair view
|
A full contact list of Tantalum with other atoms in the Ta binding
site number 2 of Crystal Structure of the Human XRCC4-Xlf Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Ta231
b:0.3
occ:0.16
|
TA2
|
D:TBR231
|
0.0
|
0.3
|
0.2
|
BRC
|
D:TBR231
|
2.6
|
0.5
|
0.2
|
BR5
|
D:TBR231
|
2.6
|
0.3
|
0.2
|
BR9
|
D:TBR231
|
2.6
|
0.4
|
0.2
|
BR1
|
D:TBR231
|
2.6
|
0.0
|
0.2
|
TA4
|
D:TBR231
|
2.9
|
0.9
|
0.2
|
TA1
|
D:TBR231
|
2.9
|
0.9
|
0.2
|
TA3
|
D:TBR231
|
2.9
|
0.4
|
0.2
|
TA6
|
D:TBR231
|
2.9
|
0.8
|
0.2
|
TA5
|
D:TBR231
|
4.1
|
1.0
|
0.2
|
BRA
|
D:TBR231
|
4.2
|
0.5
|
0.2
|
BR2
|
D:TBR231
|
4.2
|
0.4
|
0.2
|
BR4
|
D:TBR231
|
4.2
|
0.6
|
0.2
|
BR8
|
D:TBR231
|
4.2
|
0.9
|
0.2
|
|
Tantalum binding site 3 out
of 48 in 3rwr
Go back to
Tantalum Binding Sites List in 3rwr
Tantalum binding site 3 out
of 48 in the Crystal Structure of the Human XRCC4-Xlf Complex
Mono view
Stereo pair view
|
A full contact list of Tantalum with other atoms in the Ta binding
site number 3 of Crystal Structure of the Human XRCC4-Xlf Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Ta231
b:0.4
occ:0.16
|
TA3
|
D:TBR231
|
0.0
|
0.4
|
0.2
|
BRA
|
D:TBR231
|
2.6
|
0.5
|
0.2
|
BR6
|
D:TBR231
|
2.6
|
0.6
|
0.2
|
BR5
|
D:TBR231
|
2.6
|
0.3
|
0.2
|
BR2
|
D:TBR231
|
2.6
|
0.4
|
0.2
|
TA2
|
D:TBR231
|
2.9
|
0.3
|
0.2
|
TA4
|
D:TBR231
|
2.9
|
0.9
|
0.2
|
TA1
|
D:TBR231
|
2.9
|
0.9
|
0.2
|
TA5
|
D:TBR231
|
2.9
|
1.0
|
0.2
|
NE2
|
D:HIS122
|
4.1
|
0.1
|
1.0
|
BR1
|
D:TBR231
|
4.2
|
0.0
|
0.2
|
BR3
|
D:TBR231
|
4.2
|
0.8
|
0.2
|
BR9
|
D:TBR231
|
4.2
|
0.4
|
0.2
|
TA6
|
D:TBR231
|
4.2
|
0.8
|
0.2
|
BR7
|
D:TBR231
|
4.2
|
0.8
|
0.2
|
CD2
|
D:HIS122
|
4.6
|
0.4
|
1.0
|
|
Tantalum binding site 4 out
of 48 in 3rwr
Go back to
Tantalum Binding Sites List in 3rwr
Tantalum binding site 4 out
of 48 in the Crystal Structure of the Human XRCC4-Xlf Complex
Mono view
Stereo pair view
|
A full contact list of Tantalum with other atoms in the Ta binding
site number 4 of Crystal Structure of the Human XRCC4-Xlf Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Ta231
b:0.9
occ:0.16
|
TA4
|
D:TBR231
|
0.0
|
0.9
|
0.2
|
BR9
|
D:TBR231
|
2.6
|
0.4
|
0.2
|
BR8
|
D:TBR231
|
2.6
|
0.9
|
0.2
|
BR7
|
D:TBR231
|
2.6
|
0.8
|
0.2
|
BRA
|
D:TBR231
|
2.6
|
0.5
|
0.2
|
TA2
|
D:TBR231
|
2.9
|
0.3
|
0.2
|
TA5
|
D:TBR231
|
2.9
|
1.0
|
0.2
|
TA3
|
D:TBR231
|
2.9
|
0.4
|
0.2
|
TA6
|
D:TBR231
|
2.9
|
0.8
|
0.2
|
TA1
|
D:TBR231
|
4.1
|
0.9
|
0.2
|
BRC
|
D:TBR231
|
4.1
|
0.5
|
0.2
|
BR6
|
D:TBR231
|
4.2
|
0.6
|
0.2
|
BR5
|
D:TBR231
|
4.2
|
0.3
|
0.2
|
BRB
|
D:TBR231
|
4.2
|
0.8
|
0.2
|
|
Tantalum binding site 5 out
of 48 in 3rwr
Go back to
Tantalum Binding Sites List in 3rwr
Tantalum binding site 5 out
of 48 in the Crystal Structure of the Human XRCC4-Xlf Complex
Mono view
Stereo pair view
|
A full contact list of Tantalum with other atoms in the Ta binding
site number 5 of Crystal Structure of the Human XRCC4-Xlf Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Ta231
b:1.0
occ:0.16
|
TA5
|
D:TBR231
|
0.0
|
1.0
|
0.2
|
BR6
|
D:TBR231
|
2.6
|
0.6
|
0.2
|
BRB
|
D:TBR231
|
2.6
|
0.8
|
0.2
|
BR7
|
D:TBR231
|
2.6
|
0.8
|
0.2
|
BR3
|
D:TBR231
|
2.6
|
0.8
|
0.2
|
TA1
|
D:TBR231
|
2.9
|
0.9
|
0.2
|
TA4
|
D:TBR231
|
2.9
|
0.9
|
0.2
|
TA6
|
D:TBR231
|
2.9
|
0.8
|
0.2
|
TA3
|
D:TBR231
|
2.9
|
0.4
|
0.2
|
TA2
|
D:TBR231
|
4.1
|
0.3
|
0.2
|
BR4
|
D:TBR231
|
4.2
|
0.6
|
0.2
|
NE2
|
D:HIS122
|
4.2
|
0.1
|
1.0
|
BR8
|
D:TBR231
|
4.2
|
0.9
|
0.2
|
BRA
|
D:TBR231
|
4.2
|
0.5
|
0.2
|
BR2
|
D:TBR231
|
4.2
|
0.4
|
0.2
|
CD2
|
D:HIS122
|
4.3
|
0.4
|
1.0
|
|
Tantalum binding site 6 out
of 48 in 3rwr
Go back to
Tantalum Binding Sites List in 3rwr
Tantalum binding site 6 out
of 48 in the Crystal Structure of the Human XRCC4-Xlf Complex
Mono view
Stereo pair view
|
A full contact list of Tantalum with other atoms in the Ta binding
site number 6 of Crystal Structure of the Human XRCC4-Xlf Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Ta231
b:0.8
occ:0.16
|
TA6
|
D:TBR231
|
0.0
|
0.8
|
0.2
|
BR4
|
D:TBR231
|
2.6
|
0.6
|
0.2
|
BRC
|
D:TBR231
|
2.6
|
0.5
|
0.2
|
BRB
|
D:TBR231
|
2.6
|
0.8
|
0.2
|
BR8
|
D:TBR231
|
2.6
|
0.9
|
0.2
|
TA5
|
D:TBR231
|
2.9
|
1.0
|
0.2
|
TA1
|
D:TBR231
|
2.9
|
0.9
|
0.2
|
TA4
|
D:TBR231
|
2.9
|
0.9
|
0.2
|
TA2
|
D:TBR231
|
2.9
|
0.3
|
0.2
|
BR7
|
D:TBR231
|
4.2
|
0.8
|
0.2
|
BR3
|
D:TBR231
|
4.2
|
0.8
|
0.2
|
BR9
|
D:TBR231
|
4.2
|
0.4
|
0.2
|
TA3
|
D:TBR231
|
4.2
|
0.4
|
0.2
|
BR1
|
D:TBR231
|
4.2
|
0.0
|
0.2
|
|
Tantalum binding site 7 out
of 48 in 3rwr
Go back to
Tantalum Binding Sites List in 3rwr
Tantalum binding site 7 out
of 48 in the Crystal Structure of the Human XRCC4-Xlf Complex
Mono view
Stereo pair view
|
A full contact list of Tantalum with other atoms in the Ta binding
site number 7 of Crystal Structure of the Human XRCC4-Xlf Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
H:Ta231
b:0.9
occ:0.15
|
TA1
|
H:TBR231
|
0.0
|
0.9
|
0.2
|
BR3
|
H:TBR231
|
2.6
|
0.1
|
0.2
|
BR2
|
H:TBR231
|
2.6
|
0.7
|
0.2
|
BR4
|
H:TBR231
|
2.6
|
0.3
|
0.2
|
BR1
|
H:TBR231
|
2.6
|
0.2
|
0.2
|
TA5
|
H:TBR231
|
2.9
|
0.7
|
0.2
|
TA2
|
H:TBR231
|
2.9
|
0.4
|
0.2
|
TA6
|
H:TBR231
|
2.9
|
0.9
|
0.2
|
TA3
|
H:TBR231
|
2.9
|
0.9
|
0.2
|
TA4
|
H:TBR231
|
4.1
|
0.1
|
0.2
|
BR6
|
H:TBR231
|
4.1
|
0.0
|
0.2
|
BRC
|
H:TBR231
|
4.2
|
0.8
|
0.2
|
BRB
|
H:TBR231
|
4.2
|
0.1
|
0.2
|
BR5
|
H:TBR231
|
4.2
|
0.4
|
0.2
|
|
Tantalum binding site 8 out
of 48 in 3rwr
Go back to
Tantalum Binding Sites List in 3rwr
Tantalum binding site 8 out
of 48 in the Crystal Structure of the Human XRCC4-Xlf Complex
Mono view
Stereo pair view
|
A full contact list of Tantalum with other atoms in the Ta binding
site number 8 of Crystal Structure of the Human XRCC4-Xlf Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
H:Ta231
b:0.4
occ:0.15
|
TA2
|
H:TBR231
|
0.0
|
0.4
|
0.2
|
BRC
|
H:TBR231
|
2.6
|
0.8
|
0.2
|
BR5
|
H:TBR231
|
2.6
|
0.4
|
0.2
|
BR9
|
H:TBR231
|
2.6
|
0.3
|
0.2
|
BR1
|
H:TBR231
|
2.6
|
0.2
|
0.2
|
TA4
|
H:TBR231
|
2.9
|
0.1
|
0.2
|
TA1
|
H:TBR231
|
2.9
|
0.9
|
0.2
|
TA3
|
H:TBR231
|
2.9
|
0.9
|
0.2
|
TA6
|
H:TBR231
|
2.9
|
0.9
|
0.2
|
TA5
|
H:TBR231
|
4.1
|
0.7
|
0.2
|
BRA
|
H:TBR231
|
4.2
|
1.0
|
0.2
|
BR2
|
H:TBR231
|
4.2
|
0.7
|
0.2
|
BR4
|
H:TBR231
|
4.2
|
0.3
|
0.2
|
BR8
|
H:TBR231
|
4.2
|
1.0
|
0.2
|
|
Tantalum binding site 9 out
of 48 in 3rwr
Go back to
Tantalum Binding Sites List in 3rwr
Tantalum binding site 9 out
of 48 in the Crystal Structure of the Human XRCC4-Xlf Complex
Mono view
Stereo pair view
|
A full contact list of Tantalum with other atoms in the Ta binding
site number 9 of Crystal Structure of the Human XRCC4-Xlf Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
H:Ta231
b:0.9
occ:0.15
|
TA3
|
H:TBR231
|
0.0
|
0.9
|
0.2
|
BRA
|
H:TBR231
|
2.6
|
1.0
|
0.2
|
BR6
|
H:TBR231
|
2.6
|
0.0
|
0.2
|
BR5
|
H:TBR231
|
2.6
|
0.4
|
0.2
|
BR2
|
H:TBR231
|
2.6
|
0.7
|
0.2
|
TA2
|
H:TBR231
|
2.9
|
0.4
|
0.2
|
TA4
|
H:TBR231
|
2.9
|
0.1
|
0.2
|
TA1
|
H:TBR231
|
2.9
|
0.9
|
0.2
|
TA5
|
H:TBR231
|
2.9
|
0.7
|
0.2
|
BR1
|
H:TBR231
|
4.2
|
0.2
|
0.2
|
BR3
|
H:TBR231
|
4.2
|
0.1
|
0.2
|
BR9
|
H:TBR231
|
4.2
|
0.3
|
0.2
|
TA6
|
H:TBR231
|
4.2
|
0.9
|
0.2
|
BR7
|
H:TBR231
|
4.2
|
0.4
|
0.2
|
|
Tantalum binding site 10 out
of 48 in 3rwr
Go back to
Tantalum Binding Sites List in 3rwr
Tantalum binding site 10 out
of 48 in the Crystal Structure of the Human XRCC4-Xlf Complex
Mono view
Stereo pair view
|
A full contact list of Tantalum with other atoms in the Ta binding
site number 10 of Crystal Structure of the Human XRCC4-Xlf Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
H:Ta231
b:0.1
occ:0.15
|
TA4
|
H:TBR231
|
0.0
|
0.1
|
0.2
|
BR9
|
H:TBR231
|
2.6
|
0.3
|
0.2
|
BR8
|
H:TBR231
|
2.6
|
1.0
|
0.2
|
BR7
|
H:TBR231
|
2.6
|
0.4
|
0.2
|
BRA
|
H:TBR231
|
2.6
|
1.0
|
0.2
|
TA2
|
H:TBR231
|
2.9
|
0.4
|
0.2
|
TA5
|
H:TBR231
|
2.9
|
0.7
|
0.2
|
TA3
|
H:TBR231
|
2.9
|
0.9
|
0.2
|
TA6
|
H:TBR231
|
2.9
|
0.9
|
0.2
|
TA1
|
H:TBR231
|
4.1
|
0.9
|
0.2
|
BRC
|
H:TBR231
|
4.1
|
0.8
|
0.2
|
BR6
|
H:TBR231
|
4.2
|
0.0
|
0.2
|
BR5
|
H:TBR231
|
4.2
|
0.4
|
0.2
|
BRB
|
H:TBR231
|
4.2
|
0.1
|
0.2
|
|
Reference:
N.S.Andres,
C.Wyman,
M.Modesti,
M.S.Junop.
Structure of Human Xlf-XRCC4: Assembly of A Functional Dna Repair Complex To Be Published.
Page generated: Fri Oct 11 07:53:19 2024
|