Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "427bafed17c5be1b757a0fa5eab113ca",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 107.72,
"b": 176.47,
"c": 104.27,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91841],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.85,1.74],
"number_observations_unique": 200550,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.086
},
{
"type": "I/SigI",
"value": 12.340
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 6.37
}
]
},
"refln_shells": [
{
"resolution_limits": [1.79,1.74],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.694
},
{
"type": "I/SigI",
"value": 1.95
},
{
"type": "Completeness",
"value": 97.0
}
]
},
{
"resolution_limits": [1.83,1.79],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.542
},
{
"type": "I/SigI",
"value": 2.49
},
{
"type": "Completeness",
"value": 96.6
}
]
},
{
"resolution_limits": [1.89,1.83],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.428
},
{
"type": "I/SigI",
"value": 3.09
},
{
"type": "Completeness",
"value": 96.4
}
]
},
{
"resolution_limits": [1.95,1.89],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.330
},
{
"type": "I/SigI",
"value": 3.92
},
{
"type": "Completeness",
"value": 96.5
}
]
},
{
"resolution_limits": [2.01,1.95],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.282
},
{
"type": "I/SigI",
"value": 4.91
},
{
"type": "Completeness",
"value": 96.3
}
]
},
{
"resolution_limits": [2.08,2.01],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.296
},
{
"type": "I/SigI",
"value": 6.64
},
{
"type": "Completeness",
"value": 100.0
}
]
},
{
"resolution_limits": [2.16,2.08],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.228
},
{
"type": "I/SigI",
"value": 8.29
},
{
"type": "Completeness",
"value": 99.9
}
]
},
{
"resolution_limits": [2.25,2.16],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.188
},
{
"type": "I/SigI",
"value": 9.81
},
{
"type": "Completeness",
"value": 99.9
}
]
},
{
"resolution_limits": [2.35,2.25],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.157
},
{
"type": "I/SigI",
"value": 11.44
},
{
"type": "Completeness",
"value": 99.9
}
]
},
{
"resolution_limits": [2.46,2.35],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.134
},
{
"type": "I/SigI",
"value": 13.09
},
{
"type": "Completeness",
"value": 99.9
}
]
},
{
"resolution_limits": [2.59,2.46],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.114
},
{
"type": "I/SigI",
"value": 15.04
},
{
"type": "Completeness",
"value": 99.8
}
]
},
{
"resolution_limits": [2.75,2.59],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.100
},
{
"type": "I/SigI",
"value": 16.84
},
{
"type": "Completeness",
"value": 99.8
}
]
},
{
"resolution_limits": [2.94,2.75],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.083
},
{
"type": "I/SigI",
"value": 19.49
},
{
"type": "Completeness",
"value": 99.7
}
]
},
{
"resolution_limits": [3.18,2.94],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "I/SigI",
"value": 22.14
},
{
"type": "Completeness",
"value": 99.7
}
]
},
{
"resolution_limits": [3.48,3.18],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.086
},
{
"type": "I/SigI",
"value": 25.44
},
{
"type": "Completeness",
"value": 99.6
}
]
},
{
"resolution_limits": [3.89,3.48],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "I/SigI",
"value": 28.12
},
{
"type": "Completeness",
"value": 99.7
}
]
},
{
"resolution_limits": [4.49,3.89],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "I/SigI",
"value": 29.99
},
{
"type": "Completeness",
"value": 99.8
}
]
},
{
"resolution_limits": [5.50,4.49],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 30.63
},
{
"type": "Completeness",
"value": 99.8
}
]
},
{
"resolution_limits": [7.78,5.50],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "I/SigI",
"value": 29.26
},
{
"type": "Completeness",
"value": 99.8
}
]
}
]
}