Header list of 1y5c.pdb file
Complete list - 2 20 Bytes
HEADER TRANSPORT PROTEIN 02-DEC-04 1Y5C TITLE THE STRUCTURE OF A LACTOFERRICINB DERIVATIVE BOUND TO MICELLES TITLE 2 (LFCINB4-14) COMPND MOL_ID: 1; COMPND 2 MOLECULE: LACTOTRANSFERRIN; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: RESIDUES 4-14; COMPND 5 SYNONYM: LACTOFERRIN, LACTOFERRICIN B, LFCIN B; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 OTHER_DETAILS: THIS SEQUENCE IS DERIVED FROM RESIDUES 4-14 OF SOURCE 4 LACTOFERRICINB (BOVINE). KEYWDS MICELLE-BOUND, TRANSPORT PROTEIN EXPDTA SOLUTION NMR NUMMDL 20 AUTHOR L.T.NGUYEN,D.J.SCHIBLI,H.J.VOGEL REVDAT 4 02-MAR-22 1Y5C 1 REMARK REVDAT 3 24-FEB-09 1Y5C 1 VERSN REVDAT 2 20-DEC-05 1Y5C 1 JRNL REVDAT 1 22-MAR-05 1Y5C 0 JRNL AUTH L.T.NGUYEN,D.J.SCHIBLI,H.J.VOGEL JRNL TITL STRUCTURAL STUDIES AND MODEL MEMBRANE INTERACTIONS OF TWO JRNL TITL 2 PEPTIDES DERIVED FROM BOVINE LACTOFERRICIN JRNL REF J.PEPT.SCI. V. 11 379 2005 JRNL REFN ISSN 1075-2617 JRNL PMID 15635665 JRNL DOI 10.1002/PSC.629 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : NULL REMARK 3 AUTHORS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1Y5C COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 06-DEC-04. REMARK 100 THE DEPOSITION ID IS D_1000031135. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 310 REMARK 210 PH : 4.4 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 3MM LFCINB4-14 WITH 180MM SDS, REMARK 210 90% H2O, 10% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D NOESY; 2D TOCSY REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NMRPIPE, XWINNMR REMARK 210 METHOD USED : NULL REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 100 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 20 REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LOWEST REMARK 210 ENERGY REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: THIS STRUCTURE WAS DETERMINED USING STANDARD 2D REMARK 210 HOMONUCLEAR TECHNIQUES. REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 1 TRP A 3 -129.11 -161.79 REMARK 500 1 GLN A 4 51.15 -155.27 REMARK 500 1 TRP A 5 -159.84 -59.77 REMARK 500 1 ARG A 6 -49.69 -152.87 REMARK 500 1 MET A 7 35.74 -171.91 REMARK 500 2 TRP A 3 -128.14 -157.41 REMARK 500 2 GLN A 4 54.74 -155.52 REMARK 500 2 TRP A 5 -143.33 -62.09 REMARK 500 2 ARG A 6 -50.04 -172.47 REMARK 500 2 MET A 7 37.92 -174.60 REMARK 500 3 TRP A 3 -142.57 -160.17 REMARK 500 3 GLN A 4 56.46 -140.36 REMARK 500 3 TRP A 5 -143.38 -63.06 REMARK 500 3 ARG A 6 -64.81 -169.40 REMARK 500 3 MET A 7 33.76 -159.31 REMARK 500 4 TRP A 3 -141.31 -163.18 REMARK 500 4 GLN A 4 55.48 -140.77 REMARK 500 4 TRP A 5 -149.75 -61.73 REMARK 500 4 ARG A 6 -51.13 -167.58 REMARK 500 4 MET A 7 33.28 -174.82 REMARK 500 5 TRP A 3 -135.93 -170.64 REMARK 500 5 GLN A 4 53.72 -145.07 REMARK 500 5 TRP A 5 -155.16 -58.74 REMARK 500 5 ARG A 6 -61.81 -149.89 REMARK 500 5 MET A 7 44.22 -176.15 REMARK 500 6 TRP A 3 -134.10 -152.67 REMARK 500 6 GLN A 4 55.80 -157.99 REMARK 500 6 TRP A 5 -155.85 -58.29 REMARK 500 6 ARG A 6 -58.77 -151.92 REMARK 500 6 MET A 7 42.47 -175.94 REMARK 500 7 TRP A 3 -137.39 -171.36 REMARK 500 7 TRP A 5 -157.53 -62.76 REMARK 500 7 ARG A 6 -56.31 -150.67 REMARK 500 7 MET A 7 36.29 -175.46 REMARK 500 8 ARG A 2 29.69 -145.92 REMARK 500 8 TRP A 3 -130.90 -175.68 REMARK 500 8 GLN A 4 53.14 -165.11 REMARK 500 8 TRP A 5 -157.02 -58.80 REMARK 500 8 ARG A 6 -52.71 -153.07 REMARK 500 8 MET A 7 41.23 -175.27 REMARK 500 9 TRP A 3 -132.50 -156.10 REMARK 500 9 GLN A 4 53.80 -145.76 REMARK 500 9 TRP A 5 -149.85 -61.22 REMARK 500 9 ARG A 6 -60.42 -151.77 REMARK 500 9 MET A 7 31.81 -175.28 REMARK 500 10 TRP A 3 -141.15 -175.19 REMARK 500 10 TRP A 5 -144.06 -63.77 REMARK 500 10 ARG A 6 -51.44 -168.91 REMARK 500 10 MET A 7 33.89 -173.19 REMARK 500 11 TRP A 3 -139.05 -166.08 REMARK 500 REMARK 500 THIS ENTRY HAS 105 RAMACHANDRAN OUTLIERS. REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1Y58 RELATED DB: PDB REMARK 900 THE STRUCTURE OF A LACTOFERRICINB DERIVATIVE BOUND TO MICELLES REMARK 900 RELATED ID: 1LFC RELATED DB: PDB REMARK 900 NMR STRUCTURE OF THE FULL LACTOFERRICINB PEPTIDE DBREF 1Y5C A 1 11 PDB 1Y5C 1Y5C 1 11 SEQRES 1 A 11 ARG ARG TRP GLN TRP ARG MET LYS LYS LEU GLY CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 MODEL 1
Complete list - 2 20 Bytes