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Magnesium in PDB 1k5d: Crystal Structure of Ran-Gppnhp-RANBP1-Rangap Complex

Protein crystallography data

The structure of Crystal Structure of Ran-Gppnhp-RANBP1-Rangap Complex, PDB code: 1k5d was solved by M.J.Seewald, C.Koerner, A.Wittinghofer, I.R.Vetter, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 20.00 / 2.70
Space group P 1
Cell size a, b, c (Å), α, β, γ (°) 101.551, 103.109, 120.177, 71.59, 80.55, 67.78
R / Rfree (%) 23.7 / 26.7

Magnesium Binding Sites:

The binding sites of Magnesium atom in the Crystal Structure of Ran-Gppnhp-RANBP1-Rangap Complex (pdb code 1k5d). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 4 binding sites of Magnesium where determined in the Crystal Structure of Ran-Gppnhp-RANBP1-Rangap Complex, PDB code: 1k5d:
Jump to Magnesium binding site number: 1; 2; 3; 4;

Magnesium binding site 1 out of 4 in 1k5d

Go back to Magnesium Binding Sites List in 1k5d
Magnesium binding site 1 out of 4 in the Crystal Structure of Ran-Gppnhp-RANBP1-Rangap Complex


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Crystal Structure of Ran-Gppnhp-RANBP1-Rangap Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg1251

b:29.5
occ:1.00
O A:HOH1254 1.6 23.1 1.0
O A:HOH1253 1.9 46.6 1.0
O2B A:GNP1250 1.9 37.5 1.0
O1G A:GNP1250 2.0 37.5 1.0
OG1 A:THR42 2.1 17.3 1.0
OG1 A:THR24 2.4 27.1 1.0
PB A:GNP1250 3.1 37.5 1.0
PG A:GNP1250 3.1 37.5 1.0
CB A:THR24 3.3 27.1 1.0
CB A:THR42 3.3 17.3 1.0
N3B A:GNP1250 3.4 37.5 1.0
O2G A:GNP1250 3.9 37.5 1.0
N A:THR42 3.9 35.1 1.0
O1B A:GNP1250 4.1 37.5 1.0
N A:THR24 4.1 36.9 1.0
OD1 A:ASP65 4.1 37.8 1.0
O3A A:GNP1250 4.2 37.5 1.0
OD2 A:ASP65 4.2 37.8 1.0
CA A:THR42 4.2 35.1 1.0
CA A:THR24 4.3 36.9 1.0
O A:HOH1255 4.3 29.5 1.0
O3G A:GNP1250 4.3 37.5 1.0
O A:HOH1252 4.3 51.6 1.0
CG2 A:THR24 4.3 27.1 1.0
CG2 A:THR42 4.3 17.3 1.0
O2A A:GNP1250 4.4 37.5 1.0
CG A:ASP65 4.5 37.8 1.0
O1A A:GNP1250 4.5 37.5 1.0
PA A:GNP1250 4.6 37.5 1.0
C A:ALA41 4.7 30.0 1.0
O A:VAL40 4.8 30.2 1.0
O A:THR66 4.8 42.7 1.0
NZ A:LYS23 5.0 27.4 1.0
CB A:LYS23 5.0 27.4 1.0
CA A:ALA41 5.0 30.0 1.0
CE A:LYS23 5.0 27.4 1.0

Magnesium binding site 2 out of 4 in 1k5d

Go back to Magnesium Binding Sites List in 1k5d
Magnesium binding site 2 out of 4 in the Crystal Structure of Ran-Gppnhp-RANBP1-Rangap Complex


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of Crystal Structure of Ran-Gppnhp-RANBP1-Rangap Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Mg2251

b:44.2
occ:1.00
O D:HOH2254 1.7 29.9 1.0
O2B D:GNP2250 1.9 37.2 1.0
O D:HOH2253 2.0 41.9 1.0
O1G D:GNP2250 2.1 37.2 1.0
OG1 D:THR42 2.1 22.3 1.0
OG1 D:THR24 2.4 33.7 1.0
PB D:GNP2250 3.0 37.2 1.0
PG D:GNP2250 3.1 37.2 1.0
CB D:THR24 3.3 33.7 1.0
CB D:THR42 3.3 22.3 1.0
N3B D:GNP2250 3.4 37.2 1.0
O2G D:GNP2250 3.8 37.2 1.0
N D:THR42 3.9 33.5 1.0
O1B D:GNP2250 4.0 37.2 1.0
O D:HOH2252 4.0 37.2 1.0
N D:THR24 4.1 30.5 1.0
OD1 D:ASP65 4.1 52.1 1.0
O3A D:GNP2250 4.1 37.2 1.0
OD2 D:ASP65 4.1 52.1 1.0
CA D:THR42 4.2 33.5 1.0
CA D:THR24 4.2 30.5 1.0
O3G D:GNP2250 4.3 37.2 1.0
CG2 D:THR24 4.3 33.7 1.0
CG2 D:THR42 4.3 22.3 1.0
O2A D:GNP2250 4.4 37.2 1.0
CG D:ASP65 4.5 52.1 1.0
O1A D:GNP2250 4.5 37.2 1.0
PA D:GNP2250 4.6 37.2 1.0
O D:HOH2270 4.6 49.7 1.0
C D:ALA41 4.8 30.3 1.0
O D:THR66 4.8 27.2 1.0
O D:VAL40 4.8 30.2 1.0
CB D:LYS23 4.9 26.5 1.0
CE D:LYS23 5.0 26.5 1.0
NZ D:LYS23 5.0 26.5 1.0
CA D:ALA41 5.0 30.3 1.0

Magnesium binding site 3 out of 4 in 1k5d

Go back to Magnesium Binding Sites List in 1k5d
Magnesium binding site 3 out of 4 in the Crystal Structure of Ran-Gppnhp-RANBP1-Rangap Complex


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 3 of Crystal Structure of Ran-Gppnhp-RANBP1-Rangap Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
G:Mg3251

b:36.5
occ:1.00
O G:HOH3254 1.8 36.9 1.0
O G:HOH3253 2.0 62.6 1.0
O1G G:GNP3250 2.0 37.6 1.0
O2B G:GNP3250 2.0 37.6 1.0
OG1 G:THR42 2.1 34.1 1.0
OG1 G:THR24 2.4 28.6 1.0
PG G:GNP3250 3.1 37.6 1.0
PB G:GNP3250 3.1 37.6 1.0
CB G:THR42 3.2 34.1 1.0
CB G:THR24 3.3 28.6 1.0
N3B G:GNP3250 3.4 37.6 1.0
O2G G:GNP3250 3.8 37.6 1.0
N G:THR42 3.9 29.7 1.0
OD1 G:ASP65 4.1 44.6 1.0
O1B G:GNP3250 4.1 37.6 1.0
N G:THR24 4.1 29.2 1.0
CA G:THR42 4.2 29.7 1.0
O G:HOH3252 4.2 59.6 1.0
OD2 G:ASP65 4.2 44.6 1.0
O3A G:GNP3250 4.2 37.6 1.0
CA G:THR24 4.3 29.2 1.0
O3G G:GNP3250 4.3 37.6 1.0
CG2 G:THR42 4.3 34.1 1.0
CG2 G:THR24 4.3 28.6 1.0
O G:HOH3259 4.4 39.5 1.0
O2A G:GNP3250 4.5 37.6 1.0
CG G:ASP65 4.5 44.6 1.0
O1A G:GNP3250 4.6 37.6 1.0
PA G:GNP3250 4.6 37.6 1.0
C G:ALA41 4.7 40.4 1.0
O G:VAL40 4.7 33.2 1.0
O G:THR66 4.7 58.8 1.0
CA G:ALA41 4.9 40.4 1.0
CB G:LYS23 5.0 26.1 1.0
CE G:LYS23 5.0 26.1 1.0

Magnesium binding site 4 out of 4 in 1k5d

Go back to Magnesium Binding Sites List in 1k5d
Magnesium binding site 4 out of 4 in the Crystal Structure of Ran-Gppnhp-RANBP1-Rangap Complex


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 4 of Crystal Structure of Ran-Gppnhp-RANBP1-Rangap Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
J:Mg4251

b:45.0
occ:1.00
O J:HOH4254 1.7 32.0 1.0
O2B J:GNP4250 1.9 36.6 1.0
O J:HOH4253 2.0 60.1 1.0
O1G J:GNP4250 2.1 36.6 1.0
OG1 J:THR42 2.2 20.7 1.0
OG1 J:THR24 2.4 31.3 1.0
PB J:GNP4250 3.0 36.6 1.0
PG J:GNP4250 3.1 36.6 1.0
CB J:THR24 3.2 31.3 1.0
CB J:THR42 3.3 20.7 1.0
N3B J:GNP4250 3.4 36.6 1.0
O2G J:GNP4250 3.8 36.6 1.0
N J:THR42 3.9 30.7 1.0
O1B J:GNP4250 4.0 36.6 1.0
N J:THR24 4.0 29.4 1.0
O J:HOH4252 4.1 36.6 1.0
O3A J:GNP4250 4.1 36.6 1.0
OD1 J:ASP65 4.1 54.7 1.0
OD2 J:ASP65 4.2 54.7 1.0
CA J:THR42 4.2 30.7 1.0
CA J:THR24 4.2 29.4 1.0
CG2 J:THR24 4.3 31.3 1.0
O3G J:GNP4250 4.3 36.6 1.0
CG2 J:THR42 4.4 20.7 1.0
O2A J:GNP4250 4.4 36.6 1.0
O1A J:GNP4250 4.5 36.6 1.0
CG J:ASP65 4.5 54.7 1.0
O J:HOH4282 4.6 22.2 1.0
PA J:GNP4250 4.6 36.6 1.0
O J:VAL40 4.7 22.9 1.0
C J:ALA41 4.7 26.6 1.0
O J:THR66 4.8 35.1 1.0
CB J:LYS23 4.9 35.7 1.0
CE J:LYS23 5.0 35.7 1.0
CA J:ALA41 5.0 26.6 1.0
NZ J:LYS23 5.0 35.7 1.0

Reference:

M.J.Seewald, C.Korner, A.Wittinghofer, I.R.Vetter. Rangap Mediates Gtp Hydrolysis Without An Arginine Finger. Nature V. 415 662 2002.
ISSN: ISSN 0028-0836
PubMed: 11832950
DOI: 10.1038/415662A
Page generated: Tue Aug 13 07:06:48 2024

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