PDB Code: GDB
X-PLOR files
Heterogen file generated from the file hetero.pdb
COMPND GDB 1-(S-GLUTATHIONYL)-2,4-DINITROBENZENE
REMARK GDB Extracted from PDB file 5gst.pdb
REMARK GDB Formula C16 H19 N5 O10 S1
REMARK GDB Nr of non-hydrogen atoms 32
REMARK GDB Residue type GDB
REMARK GDB Residue name 511
REMARK GDB Original residue name (for O) $I218
REMARK 2 RESOLUTION. 2.0 ANGSTROMS. 5GST 38 GDB
REMARK GDB Compound also present in : 1GSQ
HETATM 1 N1 GDB 511 -3.386 -1.685 -4.301 1.00 20.00 5GST
HETATM 2 CA1 GDB 511 -3.514 -1.036 -2.952 1.00 20.00 5GST
HETATM 3 C1 GDB 511 -4.537 0.026 -2.888 1.00 20.00 5GST
HETATM 4 O11 GDB 511 -5.246 0.367 -1.972 1.00 20.00 5GST
HETATM 5 O12 GDB 511 -4.690 0.507 -4.183 1.00 20.00 5GST
HETATM 6 CB1 GDB 511 -2.212 -0.754 -2.271 1.00 20.00 5GST
HETATM 7 CG1 GDB 511 -2.538 -0.616 -0.737 1.00 20.00 5GST
HETATM 8 CD1 GDB 511 -1.216 -0.414 0.001 1.00 20.00 5GST
HETATM 9 OE1 GDB 511 -0.217 -1.040 -0.417 1.00 20.00 5GST
HETATM 10 N2 GDB 511 -1.350 0.378 1.074 1.00 20.00 5GST
HETATM 11 CA2 GDB 511 -0.272 0.806 1.950 1.00 20.00 5GST
HETATM 12 C2 GDB 511 -0.563 0.336 3.374 1.00 20.00 5GST
HETATM 13 O2 GDB 511 -0.062 0.998 4.253 1.00 20.00 5GST
HETATM 14 CB2 GDB 511 -0.004 2.309 1.850 1.00 20.00 5GST
HETATM 15 SG2 GDB 511 0.425 2.685 0.194 1.00 20.00 5GST
HETATM 16 N3 GDB 511 -1.180 -0.797 3.610 1.00 20.00 5GST
HETATM 17 CA3 GDB 511 -1.283 -1.236 5.017 1.00 20.00 5GST
HETATM 18 C3 GDB 511 -1.149 -2.718 5.167 1.00 20.00 5GST
HETATM 19 O31 GDB 511 -0.729 -3.462 4.244 1.00 20.00 5GST
HETATM 20 O32 GDB 511 -1.461 -3.388 6.304 1.00 20.00 5GST
HETATM 21 C1' GDB 511 1.737 1.721 -0.279 1.00 20.00 5GST
HETATM 22 C2' GDB 511 1.961 1.519 -1.607 1.00 20.00 5GST
HETATM 23 C3' GDB 511 2.984 0.671 -1.982 1.00 20.00 5GST
HETATM 24 C4' GDB 511 3.762 0.056 -0.987 1.00 20.00 5GST
HETATM 25 C5' GDB 511 3.534 0.257 0.361 1.00 20.00 5GST
HETATM 26 C6' GDB 511 2.527 1.107 0.721 1.00 20.00 5GST
HETATM 27 N2' GDB 511 1.234 2.095 -2.707 1.00 20.00 5GST
HETATM 28 O21 GDB 511 0.482 3.056 -2.570 1.00 20.00 5GST
HETATM 29 O22 GDB 511 1.483 1.526 -3.805 1.00 20.00 5GST
HETATM 30 N4' GDB 511 4.816 -0.790 -1.359 1.00 20.00 5GST
HETATM 31 O41 GDB 511 5.049 -1.041 -2.676 1.00 20.00 5GST
HETATM 32 O42 GDB 511 5.607 -1.434 -0.430 1.00 20.00 5GST
REMARK GDB ENDHET
REMARK